N-(5-chloro-2-methylphenyl)-4-(piperidine-1-carbonyl)benzamide

C20H21ClN2O2 — CID 109044656

IUPACN-(5-chloro-2-methylphenyl)-4-(piperidine-1-carbonyl)benzamide
SMILESCc1ccc(Cl)cc1NC(=O)c1ccc(C(=O)N2CCCCC2)cc1
InChIInChI=1S/C20H21ClN2O2/c1-14-5-10-17(21)13-18(14)22-19(24)15-6-8-16(9-7-15)20(25)23-11-3-2-4-12-23/h5-10,13H,2-4,11-12H2,1H3,(H,22,24)
InChIKeyZCSOOVCOLYEOOX-UHFFFAOYSA-N
MW356.85 g/mol
LogP4.53
Rot. Bonds3

About N-(5-chloro-2-methylphenyl)-4-(piperidine-1-carbonyl)benzamide

N-(5-chloro-2-methylphenyl)-4-(piperidine-1-carbonyl)benzamide (PubChem CID 109044656) has the molecular formula C20H21ClN2O2 and a molecular weight of 356.85 g/mol. Its IUPAC name is N-(5-chloro-2-methylphenyl)-4-(piperidine-1-carbonyl)benzamide.

Molecular Properties

Compound NameN-(5-chloro-2-methylphenyl)-4-(piperidine-1-carbonyl)benzamide
PubChem CID109044656
Molecular FormulaC20H21ClN2O2
Molecular Weight356.85 g/mol
Exact Mass356.13
IUPAC NameN-(5-chloro-2-methylphenyl)-4-(piperidine-1-carbonyl)benzamide
SMILESCc1ccc(Cl)cc1NC(=O)c1ccc(C(=O)N2CCCCC2)cc1
InChIInChI=1S/C20H21ClN2O2/c1-14-5-10-17(21)13-18(14)22-19(24)15-6-8-16(9-7-15)20(25)23-11-3-2-4-12-23/h5-10,13H,2-4,11-12H2,1H3,(H,22,24)
InChIKeyZCSOOVCOLYEOOX-UHFFFAOYSA-N
XLogP4.53
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.85
LogP ≤ 54.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-(4-acetylpiperazine-1-carbonyl)-N-(5-chloro-2-methylphenyl)benzamide
CID 109046500
N-(2,5-dichlorophenyl)-4-(piperidine-1-carbonyl)benzamide
CID 109044703
N-(5-chloro-2-methylphenyl)-2-[4-(piperidine-1-carbonyl)anilino]acetamide
CID 54841442
4-[(5-chloro-2-methylphenyl)carbamoyl]benzoic acid
CID 43386540
N-(5-chloro-2-methylphenyl)-6-(pyrrolidine-1-carbonyl)pyridine-2-carboxamide
CID 109094861
4-(azepane-1-carbonyl)-N-(2,4-dimethylphenyl)benzamide
CID 109049129
N-(5-chloro-2-methylphenyl)-1-(4-fluorobenzoyl)piperidine-3-carboxamide
CID 46650461
N-(4-chloro-2-methylphenyl)-4-(3-methylpiperidine-1-carbonyl)benzamide
CID 109048988
N-[2-methyl-5-[4-(piperidine-1-carbonyl)piperidine-1-carbonyl]phenyl]benzamide
CID 55630713
N-(5-chloro-2-methylphenyl)-4-(2,3-dihydroindole-1-carbonyl)benzamide
CID 109049544
4-chloro-N-[5-chloro-2-[4-(4-chlorobenzoyl)piperazin-1-yl]phenyl]benzamide
CID 1489362
N-(5-chloro-2-methylphenyl)piperidine-1-carbothioamide
CID 19653661

Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-methylphenyl)-4-(piperidine-1-carbonyl)benzamide?
The IUPAC name of N-(5-chloro-2-methylphenyl)-4-(piperidine-1-carbonyl)benzamide (CID 109044656) is N-(5-chloro-2-methylphenyl)-4-(piperidine-1-carbonyl)benzamide.
What is the SMILES notation for N-(5-chloro-2-methylphenyl)-4-(piperidine-1-carbonyl)benzamide?
The canonical SMILES for N-(5-chloro-2-methylphenyl)-4-(piperidine-1-carbonyl)benzamide is Cc1ccc(Cl)cc1NC(=O)c1ccc(C(=O)N2CCCCC2)cc1.
What is the InChIKey of N-(5-chloro-2-methylphenyl)-4-(piperidine-1-carbonyl)benzamide?
The InChIKey is ZCSOOVCOLYEOOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21ClN2O2/c1-14-5-10-17(21)13-18(14)22-19(24)15-6-8-16(9-7-15)20(25)23-11-3-2-4-12-23/h5-10,13H,2-4,11-12H2,1H3,(H,22,24).
What are the key properties of N-(5-chloro-2-methylphenyl)-4-(piperidine-1-carbonyl)benzamide?
N-(5-chloro-2-methylphenyl)-4-(piperidine-1-carbonyl)benzamide has a molecular weight of 356.85 g/mol, XLogP of 4.53, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2-methylphenyl)-4-(piperidine-1-carbonyl)benzamide is sourced from PubChem (CID 109044656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).