N-(4-chloro-2-methylphenyl)-4-(3-methylpiperidine-1-carbonyl)benzamide

C21H23ClN2O2 — CID 109048988

IUPACN-(4-chloro-2-methylphenyl)-4-(3-methylpiperidine-1-carbonyl)benzamide
SMILESCc1cc(Cl)ccc1NC(=O)c1ccc(C(=O)N2CCCC(C)C2)cc1
InChIInChI=1S/C21H23ClN2O2/c1-14-4-3-11-24(13-14)21(26)17-7-5-16(6-8-17)20(25)23-19-10-9-18(22)12-15(19)2/h5-10,12,14H,3-4,11,13H2,1-2H3,(H,23,25)
InChIKeyHBAULEDKRWTOJF-UHFFFAOYSA-N
MW370.88 g/mol
LogP4.77
Rot. Bonds3

About N-(4-chloro-2-methylphenyl)-4-(3-methylpiperidine-1-carbonyl)benzamide

N-(4-chloro-2-methylphenyl)-4-(3-methylpiperidine-1-carbonyl)benzamide (PubChem CID 109048988) has the molecular formula C21H23ClN2O2 and a molecular weight of 370.88 g/mol. Its IUPAC name is N-(4-chloro-2-methylphenyl)-4-(3-methylpiperidine-1-carbonyl)benzamide.

Molecular Properties

Compound NameN-(4-chloro-2-methylphenyl)-4-(3-methylpiperidine-1-carbonyl)benzamide
PubChem CID109048988
Molecular FormulaC21H23ClN2O2
Molecular Weight370.88 g/mol
Exact Mass370.14
IUPAC NameN-(4-chloro-2-methylphenyl)-4-(3-methylpiperidine-1-carbonyl)benzamide
SMILESCc1cc(Cl)ccc1NC(=O)c1ccc(C(=O)N2CCCC(C)C2)cc1
InChIInChI=1S/C21H23ClN2O2/c1-14-4-3-11-24(13-14)21(26)17-7-5-16(6-8-17)20(25)23-19-10-9-18(22)12-15(19)2/h5-10,12,14H,3-4,11,13H2,1-2H3,(H,23,25)
InChIKeyHBAULEDKRWTOJF-UHFFFAOYSA-N
XLogP4.77
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.88
LogP ≤ 54.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-(4-chloro-2-methylphenyl)-4-(3-methylpiperidine-1-carbonyl)benzamide 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

N-(2,4-dimethylphenyl)-4-(3-methylpiperidine-1-carbonyl)benzamide
CID 109048965
N-(4-chloro-2-methylphenyl)-4-(3-methylpiperidine-1-carbonyl)pyridine-2-carboxamide
CID 109090311
N-(4-chlorophenyl)-4-(3-methylpiperidine-1-carbonyl)benzamide
CID 109048985
N-[4-chloro-2-[(3S)-3-methylpiperidine-1-carbonyl]phenyl]-4-methoxybenzamide
CID 991429
N-(3,4-difluorophenyl)-4-(3-methylpiperidine-1-carbonyl)benzamide
CID 109049038
N-(2,5-dichlorophenyl)-3-(3-methylpiperidine-1-carbonyl)benzamide
CID 109056580
3-amino-N-[2-methyl-4-(3-methylpiperidine-1-carbonyl)phenyl]benzamide;hydrochloride
CID 119753451
N-(4-chloro-2-methylphenyl)-4-(3-methylpiperidine-1-carbonyl)cyclohexane-1-carboxamide
CID 109150076
1,5-dimethyl-N-[2-methyl-4-(3-methylpiperidine-1-carbonyl)phenyl]pyrrole-2-carboxamide
CID 126768610
(4-hydrazinyl-3-methylphenyl)-(3-methylpiperidin-1-yl)methanone
CID 63212098
N-(5-chloro-2-methylphenyl)-4-(piperidine-1-carbonyl)benzamide
CID 109044656
(3R)-N-(4-chloro-2-methylphenyl)-1-(3,5-dimethylbenzoyl)piperidine-3-carboxamide
CID 94082776

Frequently Asked Questions

What is the IUPAC name of N-(4-chloro-2-methylphenyl)-4-(3-methylpiperidine-1-carbonyl)benzamide?
The IUPAC name of N-(4-chloro-2-methylphenyl)-4-(3-methylpiperidine-1-carbonyl)benzamide (CID 109048988) is N-(4-chloro-2-methylphenyl)-4-(3-methylpiperidine-1-carbonyl)benzamide.
What is the SMILES notation for N-(4-chloro-2-methylphenyl)-4-(3-methylpiperidine-1-carbonyl)benzamide?
The canonical SMILES for N-(4-chloro-2-methylphenyl)-4-(3-methylpiperidine-1-carbonyl)benzamide is Cc1cc(Cl)ccc1NC(=O)c1ccc(C(=O)N2CCCC(C)C2)cc1.
What is the InChIKey of N-(4-chloro-2-methylphenyl)-4-(3-methylpiperidine-1-carbonyl)benzamide?
The InChIKey is HBAULEDKRWTOJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H23ClN2O2/c1-14-4-3-11-24(13-14)21(26)17-7-5-16(6-8-17)20(25)23-19-10-9-18(22)12-15(19)2/h5-10,12,14H,3-4,11,13H2,1-2H3,(H,23,25).
What are the key properties of N-(4-chloro-2-methylphenyl)-4-(3-methylpiperidine-1-carbonyl)benzamide?
N-(4-chloro-2-methylphenyl)-4-(3-methylpiperidine-1-carbonyl)benzamide has a molecular weight of 370.88 g/mol, XLogP of 4.77, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chloro-2-methylphenyl)-4-(3-methylpiperidine-1-carbonyl)benzamide is sourced from PubChem (CID 109048988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).