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ZINC00928599,BAS 04372610,(2-Methyl-imidazo[1,2-a]pyridin-3-yl)-piperi

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摘 要:ZINC00928599,BAS 04372610,(2-Methyl-imidazo[1,2-a]pyridin-3-yl)-piperidin-1-yl-methanone, (2-methylimidazo[3,2-a]pyridin-3-yl)-piperidin-1-ylmethanone,Canonical SMILES: CC1=C(N2C=CC=CC2=N1)C(=O)N3CCCCC3,InChI: InChI=1/C14H17N3O/c1-11-13(14(18)16-8-4-
[Synonyms]
ZINC00928599
BAS 04372610
(2-Methyl-imidazo[1,2-a]pyridin-3-yl)-piperidin-1-yl-methanone

[Structure]
ZINC00928599,BAS 04372610,(2-Methyl-imidazo[1,2-a]pyridin-3-yl)-piperi

[ Properties Computed from Structure]
Molecular Weight243.30428 [g/mol]
Molecular FormulaC14H17N3O
XLogP0
H-Bond Donor0
H-Bond Acceptor3
Rotatable Bond Count1
Exact Mass243.137162
MonoIsotopic Mass243.137162
Topological Polar Surface Area37.6
Heavy Atom Count18
Formal Charge0
Complexity314
Isotope Atom Count0
Defined Atom StereoCenter Count0
Undefined Atom StereoCenter Count0
Defined Bond StereoCenter Count0
Undefined Bond StereoCenter Count0
Covalently-Bonded Unit Count1

[ Descriptors Computed from Structure]
IUPAC Name: (2-methylimidazo[3,2-a]pyridin-3-yl)-piperidin-1-ylmethanone
Canonical SMILES: CC1=C(N2C=CC=CC2=N1)C(=O)N3CCCCC3
InChI: InChI=1/C14H17N3O/c1-11-13(14(18)16-8-4-2-5-9-16)17-10-6-3-7-12(17)15-
11/h3,6-7,10H,2,4-5,8-9H2,1H3

 
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