N-(5-chloro-2-methylphenyl)-4-imidazo[4,5-b]pyridin-3-ylpiperidine-1-carboxamide

C19H20ClN5O — CID 46286530

IUPACN-(5-chloro-2-methylphenyl)-4-imidazo[4,5-b]pyridin-3-ylpiperidine-1-carboxamide
SMILESCc1ccc(Cl)cc1NC(=O)N1CCC(n2cnc3cccnc32)CC1
InChIInChI=1S/C19H20ClN5O/c1-13-4-5-14(20)11-17(13)23-19(26)24-9-6-15(7-10-24)25-12-22-16-3-2-8-21-18(16)25/h2-5,8,11-12,15H,6-7,9-10H2,1H3,(H,23,26)
InChIKeyXBGHVVNFIKUWGP-UHFFFAOYSA-N
MW369.86 g/mol
LogP4.26
Rot. Bonds2

About N-(5-chloro-2-methylphenyl)-4-imidazo[4,5-b]pyridin-3-ylpiperidine-1-carboxamide

N-(5-chloro-2-methylphenyl)-4-imidazo[4,5-b]pyridin-3-ylpiperidine-1-carboxamide (PubChem CID 46286530) has the molecular formula C19H20ClN5O and a molecular weight of 369.86 g/mol. Its IUPAC name is N-(5-chloro-2-methylphenyl)-4-imidazo[4,5-b]pyridin-3-ylpiperidine-1-carboxamide.

Molecular Properties

Compound NameN-(5-chloro-2-methylphenyl)-4-imidazo[4,5-b]pyridin-3-ylpiperidine-1-carboxamide
PubChem CID46286530
Molecular FormulaC19H20ClN5O
Molecular Weight369.86 g/mol
Exact Mass369.14
IUPAC NameN-(5-chloro-2-methylphenyl)-4-imidazo[4,5-b]pyridin-3-ylpiperidine-1-carboxamide
SMILESCc1ccc(Cl)cc1NC(=O)N1CCC(n2cnc3cccnc32)CC1
InChIInChI=1S/C19H20ClN5O/c1-13-4-5-14(20)11-17(13)23-19(26)24-9-6-15(7-10-24)25-12-22-16-3-2-8-21-18(16)25/h2-5,8,11-12,15H,6-7,9-10H2,1H3,(H,23,26)
InChIKeyXBGHVVNFIKUWGP-UHFFFAOYSA-N
XLogP4.26
TPSA63.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.86
LogP ≤ 54.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2,3-dimethylphenyl)-4-imidazo[4,5-b]pyridin-3-ylpiperidine-1-carboxamide
CID 46286518
N-(3,5-dimethoxyphenyl)-4-imidazo[4,5-b]pyridin-3-ylpiperidine-1-carboxamide
CID 46286550
4-(7-chloro-4-oxoquinazolin-3-yl)-N-(2-ethoxyphenyl)piperidine-1-carboxamide
CID 50828166
4-(2-methylimidazo[4,5-b]pyridin-3-yl)-N-(2-methylphenyl)piperidine-1-carboxamide
CID 46286561
[1-(4-chlorophenyl)cyclobutyl]-(4-imidazo[4,5-b]pyridin-3-ylpiperidin-1-yl)methanone
CID 16674629
N-(2,5-dimethylphenyl)-4-[2-(trifluoromethyl)imidazo[4,5-b]pyridin-3-yl]piperidine-1-carboxamide
CID 46286603
N-(2,5-dichlorophenyl)-4-[2-(2-methylpropyl)imidazo[4,5-b]pyridin-3-yl]piperidine-1-carboxamide
CID 46286756
4-(6-methyl-4-oxoquinazolin-3-yl)-N-(2-methylphenyl)piperidine-1-carboxamide
CID 50828302
N-(2,5-dimethylphenyl)-3-(imidazo[4,5-b]pyridin-3-ylmethyl)piperidine-1-carboxamide
CID 91904171
(5-chloro-1H-indol-2-yl)-[(3S)-3-imidazo[4,5-b]pyridin-3-ylpyrrolidin-1-yl]methanone
CID 95826236
(4aR,8aR)-N-(5-chloro-2-methylphenyl)-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinoline-2-carboxamide
CID 51944871
(3R)-N-(5-chloro-2-methoxyphenyl)-3-(imidazo[4,5-b]pyridin-3-ylmethyl)piperidine-1-carboxamide
CID 99747517

Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-methylphenyl)-4-imidazo[4,5-b]pyridin-3-ylpiperidine-1-carboxamide?
The IUPAC name of N-(5-chloro-2-methylphenyl)-4-imidazo[4,5-b]pyridin-3-ylpiperidine-1-carboxamide (CID 46286530) is N-(5-chloro-2-methylphenyl)-4-imidazo[4,5-b]pyridin-3-ylpiperidine-1-carboxamide.
What is the SMILES notation for N-(5-chloro-2-methylphenyl)-4-imidazo[4,5-b]pyridin-3-ylpiperidine-1-carboxamide?
The canonical SMILES for N-(5-chloro-2-methylphenyl)-4-imidazo[4,5-b]pyridin-3-ylpiperidine-1-carboxamide is Cc1ccc(Cl)cc1NC(=O)N1CCC(n2cnc3cccnc32)CC1.
What is the InChIKey of N-(5-chloro-2-methylphenyl)-4-imidazo[4,5-b]pyridin-3-ylpiperidine-1-carboxamide?
The InChIKey is XBGHVVNFIKUWGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20ClN5O/c1-13-4-5-14(20)11-17(13)23-19(26)24-9-6-15(7-10-24)25-12-22-16-3-2-8-21-18(16)25/h2-5,8,11-12,15H,6-7,9-10H2,1H3,(H,23,26).
What are the key properties of N-(5-chloro-2-methylphenyl)-4-imidazo[4,5-b]pyridin-3-ylpiperidine-1-carboxamide?
N-(5-chloro-2-methylphenyl)-4-imidazo[4,5-b]pyridin-3-ylpiperidine-1-carboxamide has a molecular weight of 369.86 g/mol, XLogP of 4.26, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2-methylphenyl)-4-imidazo[4,5-b]pyridin-3-ylpiperidine-1-carboxamide is sourced from PubChem (CID 46286530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).