6-(3-chloro-2-methylanilino)-1-cyclopentyl-3-methylimidazo[4,5-c]pyridin-2-one

C19H21ClN4O — CID 163220210

IUPAC6-(3-chloro-2-methylanilino)-1-cyclopentyl-3-methylimidazo[4,5-c]pyridin-2-one
SMILESCc1c(Cl)cccc1Nc1cc2c(cn1)n(C)c(=O)n2C1CCCC1
InChIInChI=1S/C19H21ClN4O/c1-12-14(20)8-5-9-15(12)22-18-10-16-17(11-21-18)23(2)19(25)24(16)13-6-3-4-7-13/h5,8-11,13H,3-4,6-7H2,1-2H3,(H,21,22)
InChIKeyNSVVAOFXCGGNPB-UHFFFAOYSA-N
MW356.86 g/mol
LogP4.56
Rot. Bonds3

About 6-(3-chloro-2-methylanilino)-1-cyclopentyl-3-methylimidazo[4,5-c]pyridin-2-one

6-(3-chloro-2-methylanilino)-1-cyclopentyl-3-methylimidazo[4,5-c]pyridin-2-one (PubChem CID 163220210) has the molecular formula C19H21ClN4O and a molecular weight of 356.86 g/mol. Its IUPAC name is 6-(3-chloro-2-methylanilino)-1-cyclopentyl-3-methylimidazo[4,5-c]pyridin-2-one.

Molecular Properties

Compound Name6-(3-chloro-2-methylanilino)-1-cyclopentyl-3-methylimidazo[4,5-c]pyridin-2-one
PubChem CID163220210
Molecular FormulaC19H21ClN4O
Molecular Weight356.86 g/mol
Exact Mass356.14
IUPAC Name6-(3-chloro-2-methylanilino)-1-cyclopentyl-3-methylimidazo[4,5-c]pyridin-2-one
SMILESCc1c(Cl)cccc1Nc1cc2c(cn1)n(C)c(=O)n2C1CCCC1
InChIInChI=1S/C19H21ClN4O/c1-12-14(20)8-5-9-15(12)22-18-10-16-17(11-21-18)23(2)19(25)24(16)13-6-3-4-7-13/h5,8-11,13H,3-4,6-7H2,1-2H3,(H,21,22)
InChIKeyNSVVAOFXCGGNPB-UHFFFAOYSA-N
XLogP4.56
TPSA51.85 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.86
LogP ≤ 54.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 6-(3-chloro-2-methylanilino)-1-cyclopentyl-3-methylimidazo[4,5-c]pyridin-2-one with MolForge

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Related Compounds

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CID 10730997
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CID 9882393
6-Chloro-5-isopropyl-1-(3-pyridylcarbamoyl)indoline
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6-Chloro-5-ethyl-1-(3-pyridylcarbamoyl)indoline
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4-Chloro-5-tert-butyl-1-(3-pyridylcarbamoyl)indoline
CID 10687827
6-Chloro-5-propyl-1-(3-pyridylcarbamoyl)indoline
CID 10781655
6-Chloro-5-tert-butyl-1-(3-pyridylcarbamoyl)indoline
CID 10830245
9-Chloro-6-(4-methyl-piperazin-1-yl)-11H-benzo[e]pyrido[3,2-b][1,4]diazepine
CID 15654855
7-[(3R)-3-aminopiperidin-1-yl]-1-[(2-chlorophenyl)methyl]-3-methylimidazo[4,5-b]pyridin-2-one
CID 53311223
1-[4-chloro-3-(trifluoromethyl)phenyl]-3-[(3S)-1-[2-(methylamino)pyrimidin-4-yl]pyrrolidin-3-yl]urea
CID 117995615
1-(3-chloro-4-methylphenyl)-3-[(3S)-1-[2-(methylamino)pyrimidin-4-yl]pyrrolidin-3-yl]urea
CID 117995826

Frequently Asked Questions

What is the IUPAC name of 6-(3-chloro-2-methylanilino)-1-cyclopentyl-3-methylimidazo[4,5-c]pyridin-2-one?
The IUPAC name of 6-(3-chloro-2-methylanilino)-1-cyclopentyl-3-methylimidazo[4,5-c]pyridin-2-one (CID 163220210) is 6-(3-chloro-2-methylanilino)-1-cyclopentyl-3-methylimidazo[4,5-c]pyridin-2-one.
What is the SMILES notation for 6-(3-chloro-2-methylanilino)-1-cyclopentyl-3-methylimidazo[4,5-c]pyridin-2-one?
The canonical SMILES for 6-(3-chloro-2-methylanilino)-1-cyclopentyl-3-methylimidazo[4,5-c]pyridin-2-one is Cc1c(Cl)cccc1Nc1cc2c(cn1)n(C)c(=O)n2C1CCCC1.
What is the InChIKey of 6-(3-chloro-2-methylanilino)-1-cyclopentyl-3-methylimidazo[4,5-c]pyridin-2-one?
The InChIKey is NSVVAOFXCGGNPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21ClN4O/c1-12-14(20)8-5-9-15(12)22-18-10-16-17(11-21-18)23(2)19(25)24(16)13-6-3-4-7-13/h5,8-11,13H,3-4,6-7H2,1-2H3,(H,21,22).
What are the key properties of 6-(3-chloro-2-methylanilino)-1-cyclopentyl-3-methylimidazo[4,5-c]pyridin-2-one?
6-(3-chloro-2-methylanilino)-1-cyclopentyl-3-methylimidazo[4,5-c]pyridin-2-one has a molecular weight of 356.86 g/mol, XLogP of 4.56, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-chloro-2-methylanilino)-1-cyclopentyl-3-methylimidazo[4,5-c]pyridin-2-one is sourced from PubChem (CID 163220210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).