[(1R)-1-(2-chlorophenyl)ethyl] carbamate

C9H10ClNO2 — CID 89448731

IUPAC[(1R)-1-(2-chlorophenyl)ethyl] carbamate
SMILESC[C@@H](OC(N)=O)c1ccccc1Cl
InChIInChI=1S/C9H10ClNO2/c1-6(13-9(11)12)7-4-2-3-5-8(7)10/h2-6H,1H3,(H2,11,12)/t6-/m1/s1
InChIKeyFHULGPWAFAAOFK-ZCFIWIBFSA-N
MW199.64 g/mol
LogP2.50
Rot. Bonds2

About [(1R)-1-(2-chlorophenyl)ethyl] carbamate

[(1R)-1-(2-chlorophenyl)ethyl] carbamate (PubChem CID 89448731) has the molecular formula C9H10ClNO2 and a molecular weight of 199.64 g/mol. Its IUPAC name is [(1R)-1-(2-chlorophenyl)ethyl] carbamate.

Molecular Properties

Compound Name[(1R)-1-(2-chlorophenyl)ethyl] carbamate
PubChem CID89448731
Molecular FormulaC9H10ClNO2
Molecular Weight199.64 g/mol
Exact Mass199.04
IUPAC Name[(1R)-1-(2-chlorophenyl)ethyl] carbamate
SMILESC[C@@H](OC(N)=O)c1ccccc1Cl
InChIInChI=1S/C9H10ClNO2/c1-6(13-9(11)12)7-4-2-3-5-8(7)10/h2-6H,1H3,(H2,11,12)/t6-/m1/s1
InChIKeyFHULGPWAFAAOFK-ZCFIWIBFSA-N
XLogP2.50
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.64
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze [(1R)-1-(2-chlorophenyl)ethyl] 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

[(1S,2S)-1-(2-chlorophenyl)-2-hydroxypropyl] carbamate
CID 68641294
[2-carbamoyloxy-1-(2-chlorophenyl)propyl]carbamic acid
CID 175407136
[(1R)-1-(2-chlorophenyl)ethyl] butanoate
CID 141384028
1-[2-(1-chloropropyl)phenyl]ethyl carbamate
CID 67665336
1-naphthalen-1-ylethyl carbamate
CID 14959373
[(1S)-1-(2-chlorophenyl)ethyl] (2S)-2-[(2-chlorobenzoyl)amino]propanoate
CID 7570838
[(1R)-1-(2-chlorophenyl)ethyl] N-(3-methylbuta-1,3-dien-2-yl)carbamate;ethane
CID 144534242
[(1R)-1-(2-chlorophenyl)ethyl] 4-(4-hydroxyphenyl)benzoate
CID 7209531
[2-(2-chlorophenyl)-3-hydroxybutyl] carbamate
CID 174774368
[2-carbamoyloxy-2-(2-chlorophenyl)ethoxy]carbonylazanium
CID 147632611
1-(2-chlorophenyl)ethyl N-(2-amino-4-sulfanylidenepentan-3-yl)carbamate
CID 123527073
[(1S)-1-(2-chlorophenyl)ethyl] 2,4-dichloro-5-sulfamoylbenzoate
CID 8762036

Frequently Asked Questions

What is the IUPAC name of [(1R)-1-(2-chlorophenyl)ethyl] carbamate?
The IUPAC name of [(1R)-1-(2-chlorophenyl)ethyl] carbamate (CID 89448731) is [(1R)-1-(2-chlorophenyl)ethyl] carbamate.
What is the SMILES notation for [(1R)-1-(2-chlorophenyl)ethyl] carbamate?
The canonical SMILES for [(1R)-1-(2-chlorophenyl)ethyl] carbamate is C[C@@H](OC(N)=O)c1ccccc1Cl.
What is the InChIKey of [(1R)-1-(2-chlorophenyl)ethyl] carbamate?
The InChIKey is FHULGPWAFAAOFK-ZCFIWIBFSA-N. The full InChI is InChI=1S/C9H10ClNO2/c1-6(13-9(11)12)7-4-2-3-5-8(7)10/h2-6H,1H3,(H2,11,12)/t6-/m1/s1.
What are the key properties of [(1R)-1-(2-chlorophenyl)ethyl] carbamate?
[(1R)-1-(2-chlorophenyl)ethyl] carbamate has a molecular weight of 199.64 g/mol, XLogP of 2.50, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(1R)-1-(2-chlorophenyl)ethyl] carbamate is sourced from PubChem (CID 89448731), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).