1-(2-phenylimidazo[1,2-a]pyridine-6-carbonyl)piperidine-4-carbonitrile

C20H18N4O — CID 70707501

IUPAC1-(2-phenylimidazo[1,2-a]pyridine-6-carbonyl)piperidine-4-carbonitrile
SMILESN#CC1CCN(C(=O)c2ccc3nc(-c4ccccc4)cn3c2)CC1
InChIInChI=1S/C20H18N4O/c21-12-15-8-10-23(11-9-15)20(25)17-6-7-19-22-18(14-24(19)13-17)16-4-2-1-3-5-16/h1-7,13-15H,8-11H2
InChIKeyGBHIWHAMODGQMN-UHFFFAOYSA-N
MW330.39 g/mol
LogP3.38
Rot. Bonds2

About 1-(2-phenylimidazo[1,2-a]pyridine-6-carbonyl)piperidine-4-carbonitrile

1-(2-phenylimidazo[1,2-a]pyridine-6-carbonyl)piperidine-4-carbonitrile (PubChem CID 70707501) has the molecular formula C20H18N4O and a molecular weight of 330.39 g/mol. Its IUPAC name is 1-(2-phenylimidazo[1,2-a]pyridine-6-carbonyl)piperidine-4-carbonitrile.

Molecular Properties

Compound Name1-(2-phenylimidazo[1,2-a]pyridine-6-carbonyl)piperidine-4-carbonitrile
PubChem CID70707501
Molecular FormulaC20H18N4O
Molecular Weight330.39 g/mol
Exact Mass330.15
IUPAC Name1-(2-phenylimidazo[1,2-a]pyridine-6-carbonyl)piperidine-4-carbonitrile
SMILESN#CC1CCN(C(=O)c2ccc3nc(-c4ccccc4)cn3c2)CC1
InChIInChI=1S/C20H18N4O/c21-12-15-8-10-23(11-9-15)20(25)17-6-7-19-22-18(14-24(19)13-17)16-4-2-1-3-5-16/h1-7,13-15H,8-11H2
InChIKeyGBHIWHAMODGQMN-UHFFFAOYSA-N
XLogP3.38
TPSA61.40 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.39
LogP ≤ 53.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

[(3S)-3-(aminomethyl)piperidin-1-yl]-(2-phenylimidazo[1,2-a]pyridin-6-yl)methanone
CID 96574025
6-(2-phenylimidazo[1,2-a]pyridine-6-carbonyl)-1,2,4,5,7,8-hexahydropyrazolo[3,4-d]azepin-3-one
CID 70778242
(2-phenylazetidin-1-yl)-(2-phenylimidazo[1,2-a]pyridin-6-yl)methanone
CID 72915799
(2-phenylimidazo[1,2-a]pyridin-6-yl)-[(2S)-2-(pyrazol-1-ylmethyl)pyrrolidin-1-yl]methanone
CID 96578369
[1-[4-[6-(aminomethyl)imidazo[1,2-a]pyridin-2-yl]benzoyl]piperidin-4-yl] hydrogen carbonate
CID 22364124
2-(4-carboxyphenyl)imidazo[1,2-a]pyridine-6-carboxylic acid
CID 117128170
tert-butyl [1-[4-(6-cyanoimidazo[1,2-a]pyridin-2-yl)benzoyl]piperidin-4-yl] carbonate
CID 67814505
N-[1-[2-(4-fluorophenyl)imidazo[1,2-a]pyridine-6-carbonyl]pyrrolidin-3-yl]acetamide
CID 72940598
(4-aminopiperidin-1-yl)-(3-imidazo[1,2-a]pyridin-2-ylphenyl)methanone
CID 162758336
(2-methylimidazo[1,2-a]pyridin-6-yl)-(4-methylpiperidin-1-yl)methanone
CID 110704151
[2-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]-(4-methyl-1,4-diazepan-1-yl)methanone
CID 50848041
N-[(3R)-1,1-dioxothiolan-3-yl]-N-methyl-2-phenylimidazo[1,2-a]pyridine-6-carboxamide
CID 96576100

Frequently Asked Questions

What is the IUPAC name of 1-(2-phenylimidazo[1,2-a]pyridine-6-carbonyl)piperidine-4-carbonitrile?
The IUPAC name of 1-(2-phenylimidazo[1,2-a]pyridine-6-carbonyl)piperidine-4-carbonitrile (CID 70707501) is 1-(2-phenylimidazo[1,2-a]pyridine-6-carbonyl)piperidine-4-carbonitrile.
What is the SMILES notation for 1-(2-phenylimidazo[1,2-a]pyridine-6-carbonyl)piperidine-4-carbonitrile?
The canonical SMILES for 1-(2-phenylimidazo[1,2-a]pyridine-6-carbonyl)piperidine-4-carbonitrile is N#CC1CCN(C(=O)c2ccc3nc(-c4ccccc4)cn3c2)CC1.
What is the InChIKey of 1-(2-phenylimidazo[1,2-a]pyridine-6-carbonyl)piperidine-4-carbonitrile?
The InChIKey is GBHIWHAMODGQMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18N4O/c21-12-15-8-10-23(11-9-15)20(25)17-6-7-19-22-18(14-24(19)13-17)16-4-2-1-3-5-16/h1-7,13-15H,8-11H2.
What are the key properties of 1-(2-phenylimidazo[1,2-a]pyridine-6-carbonyl)piperidine-4-carbonitrile?
1-(2-phenylimidazo[1,2-a]pyridine-6-carbonyl)piperidine-4-carbonitrile has a molecular weight of 330.39 g/mol, XLogP of 3.38, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-phenylimidazo[1,2-a]pyridine-6-carbonyl)piperidine-4-carbonitrile is sourced from PubChem (CID 70707501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).