4-[2-(4-carbamoylphenyl)ethyl]benzamide

C16H16N2O2 — CID 14507735

IUPAC4-[2-(4-carbamoylphenyl)ethyl]benzamide
SMILESNC(=O)c1ccc(CCc2ccc(C(N)=O)cc2)cc1
InChIInChI=1S/C16H16N2O2/c17-15(19)13-7-3-11(4-8-13)1-2-12-5-9-14(10-6-12)16(18)20/h3-10H,1-2H2,(H2,17,19)(H2,18,20)
InChIKeyCQROIVJGYNKUCQ-UHFFFAOYSA-N
MW268.32 g/mol
LogP1.67
Rot. Bonds5

About 4-[2-(4-carbamoylphenyl)ethyl]benzamide

4-[2-(4-carbamoylphenyl)ethyl]benzamide (PubChem CID 14507735) has the molecular formula C16H16N2O2 and a molecular weight of 268.32 g/mol. Its IUPAC name is 4-[2-(4-carbamoylphenyl)ethyl]benzamide.

Molecular Properties

Compound Name4-[2-(4-carbamoylphenyl)ethyl]benzamide
PubChem CID14507735
Molecular FormulaC16H16N2O2
Molecular Weight268.32 g/mol
Exact Mass268.12
IUPAC Name4-[2-(4-carbamoylphenyl)ethyl]benzamide
SMILESNC(=O)c1ccc(CCc2ccc(C(N)=O)cc2)cc1
InChIInChI=1S/C16H16N2O2/c17-15(19)13-7-3-11(4-8-13)1-2-12-5-9-14(10-6-12)16(18)20/h3-10H,1-2H2,(H2,17,19)(H2,18,20)
InChIKeyCQROIVJGYNKUCQ-UHFFFAOYSA-N
XLogP1.67
TPSA86.18 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.32
LogP ≤ 51.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 4-[2-(4-carbamoylphenyl)ethyl]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-(2-phenylethyl)benzamide
CID 23130460
4-(2-aminoethyl)benzamide;hydrochloride
CID 23071598
[4-(aminomethyl)phenyl]methanamine;benzene-1,4-dicarboxamide
CID 68644964
4-octylbenzamide;hydrochloride
CID 131740255
4-(2-azidoethyl)benzamide
CID 22390689
potassium;benzene-1,4-dicarboxamide;hydride
CID 174539787
4-[4-(bromomethyl)phenyl]benzamide
CID 123362022
4-(4-ethylphenyl)benzamide
CID 53425878
(Z)-but-2-ene;4-ethylbenzamide
CID 143666599
(4-carbamoylphenyl)methylcarbamic acid
CID 91190690
4-(2-piperazin-1-ylethyl)benzamide
CID 84696960
4-[[2-(4-chlorophenyl)ethylamino]methyl]benzamide
CID 43232715

Frequently Asked Questions

What is the IUPAC name of 4-[2-(4-carbamoylphenyl)ethyl]benzamide?
The IUPAC name of 4-[2-(4-carbamoylphenyl)ethyl]benzamide (CID 14507735) is 4-[2-(4-carbamoylphenyl)ethyl]benzamide.
What is the SMILES notation for 4-[2-(4-carbamoylphenyl)ethyl]benzamide?
The canonical SMILES for 4-[2-(4-carbamoylphenyl)ethyl]benzamide is NC(=O)c1ccc(CCc2ccc(C(N)=O)cc2)cc1.
What is the InChIKey of 4-[2-(4-carbamoylphenyl)ethyl]benzamide?
The InChIKey is CQROIVJGYNKUCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N2O2/c17-15(19)13-7-3-11(4-8-13)1-2-12-5-9-14(10-6-12)16(18)20/h3-10H,1-2H2,(H2,17,19)(H2,18,20).
What are the key properties of 4-[2-(4-carbamoylphenyl)ethyl]benzamide?
4-[2-(4-carbamoylphenyl)ethyl]benzamide has a molecular weight of 268.32 g/mol, XLogP of 1.67, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(4-carbamoylphenyl)ethyl]benzamide is sourced from PubChem (CID 14507735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).