N-[4-[(7-chloroquinolin-4-yl)amino]cyclohexyl]-4-methylbenzamide

C23H24ClN3O — CID 10237562

IUPACN-[4-[(7-chloroquinolin-4-yl)amino]cyclohexyl]-4-methylbenzamide
SMILESCc1ccc(C(=O)NC2CCC(Nc3ccnc4cc(Cl)ccc34)CC2)cc1
InChIInChI=1S/C23H24ClN3O/c1-15-2-4-16(5-3-15)23(28)27-19-9-7-18(8-10-19)26-21-12-13-25-22-14-17(24)6-11-20(21)22/h2-6,11-14,18-19H,7-10H2,1H3,(H,25,26)(H,27,28)
InChIKeyYJRYLUWNYHPQOV-UHFFFAOYSA-N
MW393.92 g/mol
LogP5.35
Rot. Bonds4

About N-[4-[(7-chloroquinolin-4-yl)amino]cyclohexyl]-4-methylbenzamide

N-[4-[(7-chloroquinolin-4-yl)amino]cyclohexyl]-4-methylbenzamide (PubChem CID 10237562) has the molecular formula C23H24ClN3O and a molecular weight of 393.92 g/mol. Its IUPAC name is N-[4-[(7-chloroquinolin-4-yl)amino]cyclohexyl]-4-methylbenzamide.

Molecular Properties

Compound NameN-[4-[(7-chloroquinolin-4-yl)amino]cyclohexyl]-4-methylbenzamide
PubChem CID10237562
Molecular FormulaC23H24ClN3O
Molecular Weight393.92 g/mol
Exact Mass393.16
IUPAC NameN-[4-[(7-chloroquinolin-4-yl)amino]cyclohexyl]-4-methylbenzamide
SMILESCc1ccc(C(=O)NC2CCC(Nc3ccnc4cc(Cl)ccc34)CC2)cc1
InChIInChI=1S/C23H24ClN3O/c1-15-2-4-16(5-3-15)23(28)27-19-9-7-18(8-10-19)26-21-12-13-25-22-14-17(24)6-11-20(21)22/h2-6,11-14,18-19H,7-10H2,1H3,(H,25,26)(H,27,28)
InChIKeyYJRYLUWNYHPQOV-UHFFFAOYSA-N
XLogP5.35
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500393.92
LogP ≤ 55.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[4-[(7-chloroquinolin-4-yl)amino]cyclohexyl]-4-methylbenzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

AV-608
CID 9917079
(2R)-N-(4-Chlorophenyl)-2-(cis-4-(6-fluoro-4-quinolinyl)cyclohexyl)propanamide
CID 121328278
4-Chloro-N-((R)-1-(cis-4-(6-fluoroquinolin-4-yl)cyclohexyl)ethyl)benzamide
CID 121318866
((2R,4S)-2-Benzyl-4-((quinolin-4-ylmethyl)amino)piperidin-1-yl)(3,5-dimethylphenyl)methanone
CID 9869033
N-(3-(benzyl(methyl)amino)propyl)-9-chloro-5,6,7,8-tetrahydroacridine-2-carboxamide
CID 73349008
N-[7-(6-Chloro-1,2,3,4-tetrahydroacridin-9-ylamino)-heptyl]-3-(1H-indol-3-yl)propionamide
CID 11156598
N-[5-(6-Chloro-1,2,3,4-tetrahydroacridin-9-ylamino)-hexyl]-3-(1H-indol-3-yl)propionamide
CID 11249115
N-[8-(6-Chloro-1,2,3,4-tetrahydroacridin-9-ylamino)-octyl]-3-(1H-indol-3-yl)propionamide
CID 11249560
N-[7-(6-Chloro-1,2,3,4-tetrahydroacridin-9-ylamino)-heptyl]-2-(1H-indol-3-yl)acetamide
CID 11283475
N-[6-(6-Chloro-1,2,3,4-tetrahydro-acridin-9-ylamino)-hexyl]4-(1H-Indol-3-yl)-butyramide
CID 11341331
N-[5-(6-Chloro-1,2,3,4-tetrahydroacridin-9-ylamino)-pentyl]-4-(1H-indol-3-yl)butyramide
CID 11432076
4-butyl-N-(quinolin-3-yl)benzamide
CID 1860395

Frequently Asked Questions

What is the IUPAC name of N-[4-[(7-chloroquinolin-4-yl)amino]cyclohexyl]-4-methylbenzamide?
The IUPAC name of N-[4-[(7-chloroquinolin-4-yl)amino]cyclohexyl]-4-methylbenzamide (CID 10237562) is N-[4-[(7-chloroquinolin-4-yl)amino]cyclohexyl]-4-methylbenzamide.
What is the SMILES notation for N-[4-[(7-chloroquinolin-4-yl)amino]cyclohexyl]-4-methylbenzamide?
The canonical SMILES for N-[4-[(7-chloroquinolin-4-yl)amino]cyclohexyl]-4-methylbenzamide is Cc1ccc(C(=O)NC2CCC(Nc3ccnc4cc(Cl)ccc34)CC2)cc1.
What is the InChIKey of N-[4-[(7-chloroquinolin-4-yl)amino]cyclohexyl]-4-methylbenzamide?
The InChIKey is YJRYLUWNYHPQOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24ClN3O/c1-15-2-4-16(5-3-15)23(28)27-19-9-7-18(8-10-19)26-21-12-13-25-22-14-17(24)6-11-20(21)22/h2-6,11-14,18-19H,7-10H2,1H3,(H,25,26)(H,27,28).
What are the key properties of N-[4-[(7-chloroquinolin-4-yl)amino]cyclohexyl]-4-methylbenzamide?
N-[4-[(7-chloroquinolin-4-yl)amino]cyclohexyl]-4-methylbenzamide has a molecular weight of 393.92 g/mol, XLogP of 5.35, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(7-chloroquinolin-4-yl)amino]cyclohexyl]-4-methylbenzamide is sourced from PubChem (CID 10237562), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).