2-chloro-5-[(4-cyclohexylbenzoyl)amino]-N-methylbenzamide

C21H23ClN2O2 — CID 52666272

IUPAC2-chloro-5-[(4-cyclohexylbenzoyl)amino]-N-methylbenzamide
SMILESCNC(=O)c1cc(NC(=O)c2ccc(C3CCCCC3)cc2)ccc1Cl
InChIInChI=1S/C21H23ClN2O2/c1-23-21(26)18-13-17(11-12-19(18)22)24-20(25)16-9-7-15(8-10-16)14-5-3-2-4-6-14/h7-14H,2-6H2,1H3,(H,23,26)(H,24,25)
InChIKeyLIBIHNFMHSHUNB-UHFFFAOYSA-N
MW370.88 g/mol
LogP5.00
Rot. Bonds4

About 2-chloro-5-[(4-cyclohexylbenzoyl)amino]-N-methylbenzamide

2-chloro-5-[(4-cyclohexylbenzoyl)amino]-N-methylbenzamide (PubChem CID 52666272) has the molecular formula C21H23ClN2O2 and a molecular weight of 370.88 g/mol. Its IUPAC name is 2-chloro-5-[(4-cyclohexylbenzoyl)amino]-N-methylbenzamide.

Molecular Properties

Compound Name2-chloro-5-[(4-cyclohexylbenzoyl)amino]-N-methylbenzamide
PubChem CID52666272
Molecular FormulaC21H23ClN2O2
Molecular Weight370.88 g/mol
Exact Mass370.14
IUPAC Name2-chloro-5-[(4-cyclohexylbenzoyl)amino]-N-methylbenzamide
SMILESCNC(=O)c1cc(NC(=O)c2ccc(C3CCCCC3)cc2)ccc1Cl
InChIInChI=1S/C21H23ClN2O2/c1-23-21(26)18-13-17(11-12-19(18)22)24-20(25)16-9-7-15(8-10-16)14-5-3-2-4-6-14/h7-14H,2-6H2,1H3,(H,23,26)(H,24,25)
InChIKeyLIBIHNFMHSHUNB-UHFFFAOYSA-N
XLogP5.00
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.88
LogP ≤ 55.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-cyclohexylphenyl)benzamide
CID 10333838
2-chloro-N-methyl-5-[(4-phenoxybenzoyl)amino]benzamide
CID 55835370
4-cyclopentyl-N-pyridin-4-ylbenzamide
CID 110464379
3-[[4-(4-cyclohexylanilino)benzoyl]amino]benzoic acid
CID 155133623
N-[4-chloro-3-(cyclohexylcarbamoyl)phenyl]-3-iodo-4-methylbenzamide
CID 17188463
4-cyclohexyl-N'-methylbenzohydrazide
CID 116846851
2-chloro-5-(dicyclopropylmethylamino)-N-methylbenzamide
CID 54864640
N-[4-chloro-3-(methylcarbamoyl)phenyl]piperidine-4-carboxamide
CID 60926898
4-cyclohexyl-N-[5-(cyclopropanecarbonylamino)-2-methylphenyl]benzamide
CID 46478092
2-chloro-5-[(4-cyclohexylphenyl)carbamoyl]-3-fluorobenzoic acid
CID 147616775
2-chloro-5-[[4-[(3-chloro-4-fluorophenyl)sulfonylamino]benzoyl]amino]-N-methylbenzamide
CID 55990230
1-N-(4-cyclohexylphenyl)-4-N-(2H-tetrazol-5-yl)benzene-1,4-dicarboxamide
CID 22501855

Frequently Asked Questions

What is the IUPAC name of 2-chloro-5-[(4-cyclohexylbenzoyl)amino]-N-methylbenzamide?
The IUPAC name of 2-chloro-5-[(4-cyclohexylbenzoyl)amino]-N-methylbenzamide (CID 52666272) is 2-chloro-5-[(4-cyclohexylbenzoyl)amino]-N-methylbenzamide.
What is the SMILES notation for 2-chloro-5-[(4-cyclohexylbenzoyl)amino]-N-methylbenzamide?
The canonical SMILES for 2-chloro-5-[(4-cyclohexylbenzoyl)amino]-N-methylbenzamide is CNC(=O)c1cc(NC(=O)c2ccc(C3CCCCC3)cc2)ccc1Cl.
What is the InChIKey of 2-chloro-5-[(4-cyclohexylbenzoyl)amino]-N-methylbenzamide?
The InChIKey is LIBIHNFMHSHUNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H23ClN2O2/c1-23-21(26)18-13-17(11-12-19(18)22)24-20(25)16-9-7-15(8-10-16)14-5-3-2-4-6-14/h7-14H,2-6H2,1H3,(H,23,26)(H,24,25).
What are the key properties of 2-chloro-5-[(4-cyclohexylbenzoyl)amino]-N-methylbenzamide?
2-chloro-5-[(4-cyclohexylbenzoyl)amino]-N-methylbenzamide has a molecular weight of 370.88 g/mol, XLogP of 5.00, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-5-[(4-cyclohexylbenzoyl)amino]-N-methylbenzamide is sourced from PubChem (CID 52666272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).