3-(3-phenylimidazo[4,5-b]pyridin-2-yl)-1-piperidin-1-ylpropan-1-one

C20H22N4O — CID 6622705

IUPAC3-(3-phenylimidazo[4,5-b]pyridin-2-yl)-1-piperidin-1-ylpropan-1-one
SMILESO=C(CCc1nc2cccnc2n1-c1ccccc1)N1CCCCC1
InChIInChI=1S/C20H22N4O/c25-19(23-14-5-2-6-15-23)12-11-18-22-17-10-7-13-21-20(17)24(18)16-8-3-1-4-9-16/h1,3-4,7-10,13H,2,5-6,11-12,14-15H2
InChIKeyRHWWVSIRIPEUIW-UHFFFAOYSA-N
MW334.42 g/mol
LogP3.37
Rot. Bonds4

About 3-(3-phenylimidazo[4,5-b]pyridin-2-yl)-1-piperidin-1-ylpropan-1-one

3-(3-phenylimidazo[4,5-b]pyridin-2-yl)-1-piperidin-1-ylpropan-1-one (PubChem CID 6622705) has the molecular formula C20H22N4O and a molecular weight of 334.42 g/mol. Its IUPAC name is 3-(3-phenylimidazo[4,5-b]pyridin-2-yl)-1-piperidin-1-ylpropan-1-one.

Molecular Properties

Compound Name3-(3-phenylimidazo[4,5-b]pyridin-2-yl)-1-piperidin-1-ylpropan-1-one
PubChem CID6622705
Molecular FormulaC20H22N4O
Molecular Weight334.42 g/mol
Exact Mass334.18
IUPAC Name3-(3-phenylimidazo[4,5-b]pyridin-2-yl)-1-piperidin-1-ylpropan-1-one
SMILESO=C(CCc1nc2cccnc2n1-c1ccccc1)N1CCCCC1
InChIInChI=1S/C20H22N4O/c25-19(23-14-5-2-6-15-23)12-11-18-22-17-10-7-13-21-20(17)24(18)16-8-3-1-4-9-16/h1,3-4,7-10,13H,2,5-6,11-12,14-15H2
InChIKeyRHWWVSIRIPEUIW-UHFFFAOYSA-N
XLogP3.37
TPSA51.02 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.42
LogP ≤ 53.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclohexyl-3-(3-phenylimidazo[4,5-b]pyridin-2-yl)propanamide
CID 20867515
3-(1-phenylbenzimidazol-2-yl)-1-[4-(piperidine-1-carbonyl)piperidin-1-yl]propan-1-one
CID 52896555
N-benzyl-3-(3-phenylimidazo[4,5-b]pyridin-2-yl)propanamide
CID 6622635
1-(1,4-diazepan-1-yl)-3-(1-phenylbenzimidazol-2-yl)propan-1-one
CID 119414087
(3R)-1-[3-(1-phenylbenzimidazol-2-yl)propanoyl]piperidine-3-carboxylic acid
CID 129382470
N-(4-acetylphenyl)-3-(3-phenylimidazo[4,5-b]pyridin-2-yl)propanamide
CID 126458385
N-(3-methylbutyl)-3-(3-phenylimidazo[4,5-b]pyridin-2-yl)propanamide
CID 20867503
N-(oxolan-2-ylmethyl)-3-(3-phenylimidazo[4,5-b]pyridin-2-yl)propanamide
CID 6625066
(3R)-1-[3-(1-phenylbenzimidazol-2-yl)propanoyl]pyrrolidine-3-carboxylic acid
CID 125134380
[4-(2-phenylimidazo[4,5-b]pyridin-3-yl)phenyl]-piperidin-1-ylmethanone
CID 20916124
4-[3-[(4-fluorophenyl)methyl]imidazo[4,5-b]pyridin-2-yl]-1-piperidin-1-ylbutan-1-one
CID 46360225
N-[(4-methylphenyl)methyl]-4-(3-phenylimidazo[4,5-b]pyridin-2-yl)butanamide
CID 50806674

Frequently Asked Questions

What is the IUPAC name of 3-(3-phenylimidazo[4,5-b]pyridin-2-yl)-1-piperidin-1-ylpropan-1-one?
The IUPAC name of 3-(3-phenylimidazo[4,5-b]pyridin-2-yl)-1-piperidin-1-ylpropan-1-one (CID 6622705) is 3-(3-phenylimidazo[4,5-b]pyridin-2-yl)-1-piperidin-1-ylpropan-1-one.
What is the SMILES notation for 3-(3-phenylimidazo[4,5-b]pyridin-2-yl)-1-piperidin-1-ylpropan-1-one?
The canonical SMILES for 3-(3-phenylimidazo[4,5-b]pyridin-2-yl)-1-piperidin-1-ylpropan-1-one is O=C(CCc1nc2cccnc2n1-c1ccccc1)N1CCCCC1.
What is the InChIKey of 3-(3-phenylimidazo[4,5-b]pyridin-2-yl)-1-piperidin-1-ylpropan-1-one?
The InChIKey is RHWWVSIRIPEUIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N4O/c25-19(23-14-5-2-6-15-23)12-11-18-22-17-10-7-13-21-20(17)24(18)16-8-3-1-4-9-16/h1,3-4,7-10,13H,2,5-6,11-12,14-15H2.
What are the key properties of 3-(3-phenylimidazo[4,5-b]pyridin-2-yl)-1-piperidin-1-ylpropan-1-one?
3-(3-phenylimidazo[4,5-b]pyridin-2-yl)-1-piperidin-1-ylpropan-1-one has a molecular weight of 334.42 g/mol, XLogP of 3.37, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-phenylimidazo[4,5-b]pyridin-2-yl)-1-piperidin-1-ylpropan-1-one is sourced from PubChem (CID 6622705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).