2-[[2-(1-phenylcyclohexyl)acetyl]amino]benzamide

C21H24N2O2 — CID 18449632

IUPAC2-[[2-(1-phenylcyclohexyl)acetyl]amino]benzamide
SMILESNC(=O)c1ccccc1NC(=O)CC1(c2ccccc2)CCCCC1
InChIInChI=1S/C21H24N2O2/c22-20(25)17-11-5-6-12-18(17)23-19(24)15-21(13-7-2-8-14-21)16-9-3-1-4-10-16/h1,3-6,9-12H,2,7-8,13-15H2,(H2,22,25)(H,23,24)
InChIKeyUPSVAERJMQJSKP-UHFFFAOYSA-N
MW336.44 g/mol
LogP4.02
Rot. Bonds5

About 2-[[2-(1-phenylcyclohexyl)acetyl]amino]benzamide

2-[[2-(1-phenylcyclohexyl)acetyl]amino]benzamide (PubChem CID 18449632) has the molecular formula C21H24N2O2 and a molecular weight of 336.44 g/mol. Its IUPAC name is 2-[[2-(1-phenylcyclohexyl)acetyl]amino]benzamide.

Molecular Properties

Compound Name2-[[2-(1-phenylcyclohexyl)acetyl]amino]benzamide
PubChem CID18449632
Molecular FormulaC21H24N2O2
Molecular Weight336.44 g/mol
Exact Mass336.18
IUPAC Name2-[[2-(1-phenylcyclohexyl)acetyl]amino]benzamide
SMILESNC(=O)c1ccccc1NC(=O)CC1(c2ccccc2)CCCCC1
InChIInChI=1S/C21H24N2O2/c22-20(25)17-11-5-6-12-18(17)23-19(24)15-21(13-7-2-8-14-21)16-9-3-1-4-10-16/h1,3-6,9-12H,2,7-8,13-15H2,(H2,22,25)(H,23,24)
InChIKeyUPSVAERJMQJSKP-UHFFFAOYSA-N
XLogP4.02
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.44
LogP ≤ 54.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-aminophenyl)-2-(1-phenylcyclohexyl)acetamide
CID 18449743
2-[(1-phenylcyclopentanecarbonyl)amino]benzamide
CID 28624302
1-(aminomethyl)-N-(2-carbamoylphenyl)cycloheptane-1-carboxamide
CID 115443739
2-[[2-[1-(methylamino)cyclohexyl]acetyl]amino]benzoic acid
CID 65242547
2-[[1-(aminomethyl)cyclopentanecarbonyl]amino]benzamide
CID 115434729
1-(2-carbamoylanilino)cyclohexane-1-carboxylic acid
CID 61291221
2-oxo-3-(1-phenylcyclohexyl)propanoic acid
CID 18551192
N-(3-acetyl-4-pyridinyl)-2-(1-phenylcyclopropyl)acetamide
CID 166250399
2-[[2-(1,2,2-trimethylcyclohexyl)acetyl]amino]benzoic acid
CID 175270088
2-(3-aminopropanoylamino)benzamide
CID 22692052
2-[[1-(aminomethyl)cyclopentyl]amino]benzamide
CID 63887827
1-[2-[2-(diethylcarbamoyl)anilino]-2-oxoethyl]cycloheptane-1-carboxylic acid
CID 47704266

Frequently Asked Questions

What is the IUPAC name of 2-[[2-(1-phenylcyclohexyl)acetyl]amino]benzamide?
The IUPAC name of 2-[[2-(1-phenylcyclohexyl)acetyl]amino]benzamide (CID 18449632) is 2-[[2-(1-phenylcyclohexyl)acetyl]amino]benzamide.
What is the SMILES notation for 2-[[2-(1-phenylcyclohexyl)acetyl]amino]benzamide?
The canonical SMILES for 2-[[2-(1-phenylcyclohexyl)acetyl]amino]benzamide is NC(=O)c1ccccc1NC(=O)CC1(c2ccccc2)CCCCC1.
What is the InChIKey of 2-[[2-(1-phenylcyclohexyl)acetyl]amino]benzamide?
The InChIKey is UPSVAERJMQJSKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24N2O2/c22-20(25)17-11-5-6-12-18(17)23-19(24)15-21(13-7-2-8-14-21)16-9-3-1-4-10-16/h1,3-6,9-12H,2,7-8,13-15H2,(H2,22,25)(H,23,24).
What are the key properties of 2-[[2-(1-phenylcyclohexyl)acetyl]amino]benzamide?
2-[[2-(1-phenylcyclohexyl)acetyl]amino]benzamide has a molecular weight of 336.44 g/mol, XLogP of 4.02, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(1-phenylcyclohexyl)acetyl]amino]benzamide is sourced from PubChem (CID 18449632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).