N-benzyl-N-ethyl-1-phenylcyclopropane-1-carboxamide

C19H21NO — CID 113198157

IUPACN-benzyl-N-ethyl-1-phenylcyclopropane-1-carboxamide
SMILESCCN(Cc1ccccc1)C(=O)C1(c2ccccc2)CC1
InChIInChI=1S/C19H21NO/c1-2-20(15-16-9-5-3-6-10-16)18(21)19(13-14-19)17-11-7-4-8-12-17/h3-12H,2,13-15H2,1H3
InChIKeyWEVOTEOBJGLERM-UHFFFAOYSA-N
MW279.38 g/mol
LogP3.77
Rot. Bonds5

About N-benzyl-N-ethyl-1-phenylcyclopropane-1-carboxamide

N-benzyl-N-ethyl-1-phenylcyclopropane-1-carboxamide (PubChem CID 113198157) has the molecular formula C19H21NO and a molecular weight of 279.38 g/mol. Its IUPAC name is N-benzyl-N-ethyl-1-phenylcyclopropane-1-carboxamide.

Molecular Properties

Compound NameN-benzyl-N-ethyl-1-phenylcyclopropane-1-carboxamide
PubChem CID113198157
Molecular FormulaC19H21NO
Molecular Weight279.38 g/mol
Exact Mass279.16
IUPAC NameN-benzyl-N-ethyl-1-phenylcyclopropane-1-carboxamide
SMILESCCN(Cc1ccccc1)C(=O)C1(c2ccccc2)CC1
InChIInChI=1S/C19H21NO/c1-2-20(15-16-9-5-3-6-10-16)18(21)19(13-14-19)17-11-7-4-8-12-17/h3-12H,2,13-15H2,1H3
InChIKeyWEVOTEOBJGLERM-UHFFFAOYSA-N
XLogP3.77
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.38
LogP ≤ 53.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze N-benzyl-N-ethyl-1-phenylcyclopropane-1-carboxamide 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-[ethyl-(1-phenylcyclopropanecarbonyl)amino]acetic acid
CID 54900888
N,N-diethyl-4-phenylpiperidine-4-carboxamide
CID 22361711
N-(3-bromopropyl)-N-ethyl-1-phenylcyclopropane-1-carboxamide
CID 113469199
N-benzyl-1-phenyl-N-propan-2-ylcyclopropane-1-carboxamide
CID 113198160
N,N'-dibenzyl-N,N'-diethyloxamide
CID 3417048
N-[(5-chlorothiophen-2-yl)methyl]-N-ethyl-1-phenylcyclobutane-1-carboxamide
CID 134040980
N-(2-chloroethyl)-1-phenyl-N-propylcyclopropane-1-carboxamide
CID 63392759
3-[benzyl(ethyl)amino]-2,2-dimethyl-3-oxopropanoic acid
CID 82812836
N-(2-amino-2-oxoethyl)-N-[(3-chlorophenyl)methyl]-1-phenylcyclopropane-1-carboxamide
CID 144888029
N,N-diethyl-4-[[(1-phenylcyclopropanecarbonyl)amino]methyl]benzamide
CID 34833770
N-benzyl-N-ethylcarbamoyl chloride
CID 10679448
N,N'-dibenzyl-N,N'-diethylpropanediamide
CID 2392254

Frequently Asked Questions

What is the IUPAC name of N-benzyl-N-ethyl-1-phenylcyclopropane-1-carboxamide?
The IUPAC name of N-benzyl-N-ethyl-1-phenylcyclopropane-1-carboxamide (CID 113198157) is N-benzyl-N-ethyl-1-phenylcyclopropane-1-carboxamide.
What is the SMILES notation for N-benzyl-N-ethyl-1-phenylcyclopropane-1-carboxamide?
The canonical SMILES for N-benzyl-N-ethyl-1-phenylcyclopropane-1-carboxamide is CCN(Cc1ccccc1)C(=O)C1(c2ccccc2)CC1.
What is the InChIKey of N-benzyl-N-ethyl-1-phenylcyclopropane-1-carboxamide?
The InChIKey is WEVOTEOBJGLERM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21NO/c1-2-20(15-16-9-5-3-6-10-16)18(21)19(13-14-19)17-11-7-4-8-12-17/h3-12H,2,13-15H2,1H3.
What are the key properties of N-benzyl-N-ethyl-1-phenylcyclopropane-1-carboxamide?
N-benzyl-N-ethyl-1-phenylcyclopropane-1-carboxamide has a molecular weight of 279.38 g/mol, XLogP of 3.77, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N-ethyl-1-phenylcyclopropane-1-carboxamide is sourced from PubChem (CID 113198157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).