1-phenylethyl N-(2-chlorophenyl)carbamate

C15H14ClNO2 — CID 174361176

IUPAC1-phenylethyl N-(2-chlorophenyl)carbamate
SMILESCC(OC(=O)Nc1ccccc1Cl)c1ccccc1
InChIInChI=1S/C15H14ClNO2/c1-11(12-7-3-2-4-8-12)19-15(18)17-14-10-6-5-9-13(14)16/h2-11H,1H3,(H,17,18)
InChIKeyKUKVQIKKPYRIBX-UHFFFAOYSA-N
MW275.74 g/mol
LogP4.65
Rot. Bonds3

About 1-phenylethyl N-(2-chlorophenyl)carbamate

1-phenylethyl N-(2-chlorophenyl)carbamate (PubChem CID 174361176) has the molecular formula C15H14ClNO2 and a molecular weight of 275.74 g/mol. Its IUPAC name is 1-phenylethyl N-(2-chlorophenyl)carbamate.

Molecular Properties

Compound Name1-phenylethyl N-(2-chlorophenyl)carbamate
PubChem CID174361176
Molecular FormulaC15H14ClNO2
Molecular Weight275.74 g/mol
Exact Mass275.07
IUPAC Name1-phenylethyl N-(2-chlorophenyl)carbamate
SMILESCC(OC(=O)Nc1ccccc1Cl)c1ccccc1
InChIInChI=1S/C15H14ClNO2/c1-11(12-7-3-2-4-8-12)19-15(18)17-14-10-6-5-9-13(14)16/h2-11H,1H3,(H,17,18)
InChIKeyKUKVQIKKPYRIBX-UHFFFAOYSA-N
XLogP4.65
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.74
LogP ≤ 54.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-phenylethyl N-(2-chlorophenyl)carbamate 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

N-(2-chlorophenyl)-2-phenylpropanamide
CID 70678301
[2-(2-chloroanilino)-2-oxoethyl] (2R,3S)-3-methyl-2-phenylpentanoate
CID 7772957
N-(2-chlorophenyl)-N'-[(1R)-1-phenylethyl]oxamide
CID 2291188
[1-(2-chloroanilino)-1-oxopropan-2-yl] 3-methyl-2-phenylpentanoate
CID 55422375
methyl 2-[(2-chlorophenyl)carbamoyloxy]-3-methylbut-3-enoate
CID 22150907
1-benzhydryl-3-(2-chlorophenyl)urea
CID 108867386
1-phenylethyl N-carbamoylcarbamate
CID 3027881
[(1R)-1-phenylethyl] 2-chloroacetate
CID 14113253
1-(6-methyl-[1,3]oxazolo[3,2-b][1,2,4]triazol-5-yl)ethyl N-(2-chlorophenyl)carbamate
CID 53325597
N-(2-chlorophenyl)-2-phenoxypropanamide
CID 2897832
(2R)-N-(2-chlorophenyl)-2-phenoxypropanamide
CID 837154
[(1S)-1-(4-fluorophenyl)ethyl] N-phenylcarbamate
CID 174582664

Frequently Asked Questions

What is the IUPAC name of 1-phenylethyl N-(2-chlorophenyl)carbamate?
The IUPAC name of 1-phenylethyl N-(2-chlorophenyl)carbamate (CID 174361176) is 1-phenylethyl N-(2-chlorophenyl)carbamate.
What is the SMILES notation for 1-phenylethyl N-(2-chlorophenyl)carbamate?
The canonical SMILES for 1-phenylethyl N-(2-chlorophenyl)carbamate is CC(OC(=O)Nc1ccccc1Cl)c1ccccc1.
What is the InChIKey of 1-phenylethyl N-(2-chlorophenyl)carbamate?
The InChIKey is KUKVQIKKPYRIBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14ClNO2/c1-11(12-7-3-2-4-8-12)19-15(18)17-14-10-6-5-9-13(14)16/h2-11H,1H3,(H,17,18).
What are the key properties of 1-phenylethyl N-(2-chlorophenyl)carbamate?
1-phenylethyl N-(2-chlorophenyl)carbamate has a molecular weight of 275.74 g/mol, XLogP of 4.65, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenylethyl N-(2-chlorophenyl)carbamate is sourced from PubChem (CID 174361176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).