4-(2-phenylethylcarbamoylamino)benzamide

C16H17N3O2 — CID 108888099

IUPAC4-(2-phenylethylcarbamoylamino)benzamide
SMILESNC(=O)c1ccc(NC(=O)NCCc2ccccc2)cc1
InChIInChI=1S/C16H17N3O2/c17-15(20)13-6-8-14(9-7-13)19-16(21)18-11-10-12-4-2-1-3-5-12/h1-9H,10-11H2,(H2,17,20)(H2,18,19,21)
InChIKeyCONHCRWAKKYMCR-UHFFFAOYSA-N
MW283.33 g/mol
LogP2.15
Rot. Bonds5

About 4-(2-phenylethylcarbamoylamino)benzamide

4-(2-phenylethylcarbamoylamino)benzamide (PubChem CID 108888099) has the molecular formula C16H17N3O2 and a molecular weight of 283.33 g/mol. Its IUPAC name is 4-(2-phenylethylcarbamoylamino)benzamide.

Molecular Properties

Compound Name4-(2-phenylethylcarbamoylamino)benzamide
PubChem CID108888099
Molecular FormulaC16H17N3O2
Molecular Weight283.33 g/mol
Exact Mass283.13
IUPAC Name4-(2-phenylethylcarbamoylamino)benzamide
SMILESNC(=O)c1ccc(NC(=O)NCCc2ccccc2)cc1
InChIInChI=1S/C16H17N3O2/c17-15(20)13-6-8-14(9-7-13)19-16(21)18-11-10-12-4-2-1-3-5-12/h1-9H,10-11H2,(H2,17,20)(H2,18,19,21)
InChIKeyCONHCRWAKKYMCR-UHFFFAOYSA-N
XLogP2.15
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.33
LogP ≤ 52.15
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

Analyze 4-(2-phenylethylcarbamoylamino)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

4-[(phenylcarbamoylamino)methyl]benzamide
CID 47118035
ethyl N-[4-(2-phenylethylcarbamoylamino)phenyl]carbamate
CID 47039610
4-(3-phenylpropanoylamino)benzamide
CID 675903
1-[4-(difluoromethoxy)phenyl]-3-(2-phenylethyl)urea
CID 59649482
1-(3-hydroxyphenyl)-3-(2-phenylethyl)urea
CID 108888024
1-(3,4-dimethylphenyl)-3-(2-phenylethyl)urea
CID 6470547
4-[2-(4-fluorophenyl)ethylcarbamothioylamino]benzamide
CID 18416469
N-[4-(2-phenylethylcarbamoylamino)phenyl]furan-2-carboxamide
CID 38205482
1-(4-aminophenyl)-3-(4-phenylbutyl)urea
CID 108897090
6-[(4-carbamoylphenyl)carbamoylamino]hexanoic acid
CID 61185640
4-[2-(4-chlorophenyl)ethylcarbamoylamino]benzoic acid
CID 108891822
4-(2-phenylethyl)benzamide
CID 23130460

Frequently Asked Questions

What is the IUPAC name of 4-(2-phenylethylcarbamoylamino)benzamide?
The IUPAC name of 4-(2-phenylethylcarbamoylamino)benzamide (CID 108888099) is 4-(2-phenylethylcarbamoylamino)benzamide.
What is the SMILES notation for 4-(2-phenylethylcarbamoylamino)benzamide?
The canonical SMILES for 4-(2-phenylethylcarbamoylamino)benzamide is NC(=O)c1ccc(NC(=O)NCCc2ccccc2)cc1.
What is the InChIKey of 4-(2-phenylethylcarbamoylamino)benzamide?
The InChIKey is CONHCRWAKKYMCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3O2/c17-15(20)13-6-8-14(9-7-13)19-16(21)18-11-10-12-4-2-1-3-5-12/h1-9H,10-11H2,(H2,17,20)(H2,18,19,21).
What are the key properties of 4-(2-phenylethylcarbamoylamino)benzamide?
4-(2-phenylethylcarbamoylamino)benzamide has a molecular weight of 283.33 g/mol, XLogP of 2.15, 5 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-phenylethylcarbamoylamino)benzamide is sourced from PubChem (CID 108888099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).