2-[cyclopropanecarbonyl(methyl)amino]-N-(2-phenylbutyl)benzamide

C22H26N2O2 — CID 46494345

IUPAC2-[cyclopropanecarbonyl(methyl)amino]-N-(2-phenylbutyl)benzamide
SMILESCCC(CNC(=O)c1ccccc1N(C)C(=O)C1CC1)c1ccccc1
InChIInChI=1S/C22H26N2O2/c1-3-16(17-9-5-4-6-10-17)15-23-21(25)19-11-7-8-12-20(19)24(2)22(26)18-13-14-18/h4-12,16,18H,3,13-15H2,1-2H3,(H,23,25)
InChIKeyVXONDFOLMIJNGZ-UHFFFAOYSA-N
MW350.46 g/mol
LogP3.98
Rot. Bonds7

About 2-[cyclopropanecarbonyl(methyl)amino]-N-(2-phenylbutyl)benzamide

2-[cyclopropanecarbonyl(methyl)amino]-N-(2-phenylbutyl)benzamide (PubChem CID 46494345) has the molecular formula C22H26N2O2 and a molecular weight of 350.46 g/mol. Its IUPAC name is 2-[cyclopropanecarbonyl(methyl)amino]-N-(2-phenylbutyl)benzamide.

Molecular Properties

Compound Name2-[cyclopropanecarbonyl(methyl)amino]-N-(2-phenylbutyl)benzamide
PubChem CID46494345
Molecular FormulaC22H26N2O2
Molecular Weight350.46 g/mol
Exact Mass350.20
IUPAC Name2-[cyclopropanecarbonyl(methyl)amino]-N-(2-phenylbutyl)benzamide
SMILESCCC(CNC(=O)c1ccccc1N(C)C(=O)C1CC1)c1ccccc1
InChIInChI=1S/C22H26N2O2/c1-3-16(17-9-5-4-6-10-17)15-23-21(25)19-11-7-8-12-20(19)24(2)22(26)18-13-14-18/h4-12,16,18H,3,13-15H2,1-2H3,(H,23,25)
InChIKeyVXONDFOLMIJNGZ-UHFFFAOYSA-N
XLogP3.98
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.46
LogP ≤ 53.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-[cyclopropanecarbonyl(methyl)amino]-N-(2-phenylbutyl)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

2-[[[2-[cyclopropanecarbonyl(methyl)amino]benzoyl]amino]methyl]-4-methylpentanoic acid
CID 119252709
2-[[2-[cyclopropanecarbonyl(methyl)amino]benzoyl]amino]propanoic acid
CID 119224969
4-[[[2-[cyclopropanecarbonyl(methyl)amino]benzoyl]amino]methyl]oxane-4-carboxylic acid
CID 120542790
5-[[[2-[cyclopropanecarbonyl(methyl)amino]benzoyl]amino]methyl]thiophene-2-carboxylic acid
CID 122110839
N-[(2S)-2-phenylbutyl]cyclobutanecarboxamide
CID 39952483
2,5-dimethyl-N-(2-phenylbutyl)thiophene-3-carboxamide
CID 47113989
2-[3-[[2-[cyclopropanecarbonyl(methyl)amino]benzoyl]amino]phenyl]acetic acid
CID 119351711
2-[cyclopropanecarbonyl(methyl)amino]-N-[2-(4-propan-2-yloxyphenyl)ethyl]benzamide
CID 55966441
N-(4-aminocyclohexyl)-2-[cyclopropanecarbonyl(methyl)amino]benzamide
CID 119478823
2-(oxolan-2-ylmethylsulfanyl)-N-(2-phenylbutyl)benzamide
CID 43016040
2-[cyclopropanecarbonyl(methyl)amino]-N-[4-(2-oxo-1-pyridinyl)butyl]benzamide
CID 86855571
N-[2-[[(4-bromobenzoyl)amino]carbamoyl]phenyl]-N-methylcyclopropanecarboxamide
CID 78886695

Frequently Asked Questions

What is the IUPAC name of 2-[cyclopropanecarbonyl(methyl)amino]-N-(2-phenylbutyl)benzamide?
The IUPAC name of 2-[cyclopropanecarbonyl(methyl)amino]-N-(2-phenylbutyl)benzamide (CID 46494345) is 2-[cyclopropanecarbonyl(methyl)amino]-N-(2-phenylbutyl)benzamide.
What is the SMILES notation for 2-[cyclopropanecarbonyl(methyl)amino]-N-(2-phenylbutyl)benzamide?
The canonical SMILES for 2-[cyclopropanecarbonyl(methyl)amino]-N-(2-phenylbutyl)benzamide is CCC(CNC(=O)c1ccccc1N(C)C(=O)C1CC1)c1ccccc1.
What is the InChIKey of 2-[cyclopropanecarbonyl(methyl)amino]-N-(2-phenylbutyl)benzamide?
The InChIKey is VXONDFOLMIJNGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26N2O2/c1-3-16(17-9-5-4-6-10-17)15-23-21(25)19-11-7-8-12-20(19)24(2)22(26)18-13-14-18/h4-12,16,18H,3,13-15H2,1-2H3,(H,23,25).
What are the key properties of 2-[cyclopropanecarbonyl(methyl)amino]-N-(2-phenylbutyl)benzamide?
2-[cyclopropanecarbonyl(methyl)amino]-N-(2-phenylbutyl)benzamide has a molecular weight of 350.46 g/mol, XLogP of 3.98, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclopropanecarbonyl(methyl)amino]-N-(2-phenylbutyl)benzamide is sourced from PubChem (CID 46494345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).