3-[2-(3H-imidazo[4,5-c]pyridin-2-yl)pyrrolidine-1-carbonyl]-N,N-dimethylpiperidine-1-carboxamide

C19H26N6O2 — CID 134798379

IUPAC3-[2-(3H-imidazo[4,5-c]pyridin-2-yl)pyrrolidine-1-carbonyl]-N,N-dimethylpiperidine-1-carboxamide
SMILESCN(C)C(=O)N1CCCC(C(=O)N2CCCC2c2nc3ccncc3[nH]2)C1
InChIInChI=1S/C19H26N6O2/c1-23(2)19(27)24-9-3-5-13(12-24)18(26)25-10-4-6-16(25)17-21-14-7-8-20-11-15(14)22-17/h7-8,11,13,16H,3-6,9-10,12H2,1-2H3,(H,21,22)
InChIKeyBXPGYZPXPKDWML-UHFFFAOYSA-N
MW370.46 g/mol
LogP2.02
Rot. Bonds2

About 3-[2-(3H-imidazo[4,5-c]pyridin-2-yl)pyrrolidine-1-carbonyl]-N,N-dimethylpiperidine-1-carboxamide

3-[2-(3H-imidazo[4,5-c]pyridin-2-yl)pyrrolidine-1-carbonyl]-N,N-dimethylpiperidine-1-carboxamide (PubChem CID 134798379) has the molecular formula C19H26N6O2 and a molecular weight of 370.46 g/mol. Its IUPAC name is 3-[2-(3H-imidazo[4,5-c]pyridin-2-yl)pyrrolidine-1-carbonyl]-N,N-dimethylpiperidine-1-carboxamide.

Molecular Properties

Compound Name3-[2-(3H-imidazo[4,5-c]pyridin-2-yl)pyrrolidine-1-carbonyl]-N,N-dimethylpiperidine-1-carboxamide
PubChem CID134798379
Molecular FormulaC19H26N6O2
Molecular Weight370.46 g/mol
Exact Mass370.21
IUPAC Name3-[2-(3H-imidazo[4,5-c]pyridin-2-yl)pyrrolidine-1-carbonyl]-N,N-dimethylpiperidine-1-carboxamide
SMILESCN(C)C(=O)N1CCCC(C(=O)N2CCCC2c2nc3ccncc3[nH]2)C1
InChIInChI=1S/C19H26N6O2/c1-23(2)19(27)24-9-3-5-13(12-24)18(26)25-10-4-6-16(25)17-21-14-7-8-20-11-15(14)22-17/h7-8,11,13,16H,3-6,9-10,12H2,1-2H3,(H,21,22)
InChIKeyBXPGYZPXPKDWML-UHFFFAOYSA-N
XLogP2.02
TPSA85.43 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.46
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[3-[2-(3H-imidazo[4,5-c]pyridin-2-yl)pyrrolidine-1-carbonyl]piperidin-1-yl]-2,2-dimethylpropan-1-one
CID 134795190
cyclopentyl-[3-[3-(3H-imidazo[4,5-c]pyridin-2-yl)pyrrolidine-1-carbonyl]piperidin-1-yl]methanone
CID 134798256
cyclopentyl-[3-[4-(3H-imidazo[4,5-c]pyridin-2-yl)piperidine-1-carbonyl]piperidin-1-yl]methanone
CID 134797363
(1-benzoylpiperidin-3-yl)-[4-(3H-imidazo[4,5-c]pyridin-2-yl)piperidin-1-yl]methanone
CID 134795960
cyclopropyl-[(3R)-3-[(2R)-2-(1H-imidazol-2-yl)piperidine-1-carbonyl]piperidin-1-yl]methanone
CID 97084883
N-(4-chlorophenyl)-3-[3-(3H-imidazo[4,5-c]pyridin-2-yl)pyrrolidine-1-carbonyl]piperidine-1-carboxamide
CID 134796934
[1-(6-chloropyridine-3-carbonyl)pyrrolidin-2-yl]-[2-(3H-imidazo[4,5-c]pyridin-2-yl)pyrrolidin-1-yl]methanone
CID 134796415
3-(azepane-1-carbonyl)-N,N-dimethylpiperidine-1-carboxamide
CID 60756295
4-[(2S)-2-(1H-benzimidazol-2-yl)pyrrolidine-1-carbonyl]-1-methylpyrrolidin-2-one
CID 110205528
1-[2-(1H-benzimidazol-2-yl)pyrrolidin-1-yl]ethanone
CID 43841790
(3R)-N,N-dimethyl-3-(4-pyridin-3-ylpiperazine-1-carbonyl)piperidine-1-carboxamide
CID 97191479
methyl 4-[3-(3H-imidazo[4,5-c]pyridin-2-yl)pyrrolidine-1-carbonyl]piperidine-1-carboxylate
CID 134796420

Frequently Asked Questions

What is the IUPAC name of 3-[2-(3H-imidazo[4,5-c]pyridin-2-yl)pyrrolidine-1-carbonyl]-N,N-dimethylpiperidine-1-carboxamide?
The IUPAC name of 3-[2-(3H-imidazo[4,5-c]pyridin-2-yl)pyrrolidine-1-carbonyl]-N,N-dimethylpiperidine-1-carboxamide (CID 134798379) is 3-[2-(3H-imidazo[4,5-c]pyridin-2-yl)pyrrolidine-1-carbonyl]-N,N-dimethylpiperidine-1-carboxamide.
What is the SMILES notation for 3-[2-(3H-imidazo[4,5-c]pyridin-2-yl)pyrrolidine-1-carbonyl]-N,N-dimethylpiperidine-1-carboxamide?
The canonical SMILES for 3-[2-(3H-imidazo[4,5-c]pyridin-2-yl)pyrrolidine-1-carbonyl]-N,N-dimethylpiperidine-1-carboxamide is CN(C)C(=O)N1CCCC(C(=O)N2CCCC2c2nc3ccncc3[nH]2)C1.
What is the InChIKey of 3-[2-(3H-imidazo[4,5-c]pyridin-2-yl)pyrrolidine-1-carbonyl]-N,N-dimethylpiperidine-1-carboxamide?
The InChIKey is BXPGYZPXPKDWML-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N6O2/c1-23(2)19(27)24-9-3-5-13(12-24)18(26)25-10-4-6-16(25)17-21-14-7-8-20-11-15(14)22-17/h7-8,11,13,16H,3-6,9-10,12H2,1-2H3,(H,21,22).
What are the key properties of 3-[2-(3H-imidazo[4,5-c]pyridin-2-yl)pyrrolidine-1-carbonyl]-N,N-dimethylpiperidine-1-carboxamide?
3-[2-(3H-imidazo[4,5-c]pyridin-2-yl)pyrrolidine-1-carbonyl]-N,N-dimethylpiperidine-1-carboxamide has a molecular weight of 370.46 g/mol, XLogP of 2.02, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(3H-imidazo[4,5-c]pyridin-2-yl)pyrrolidine-1-carbonyl]-N,N-dimethylpiperidine-1-carboxamide is sourced from PubChem (CID 134798379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).