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

C15H14ClNO2 — CID 81378918

IUPACphenyl N-[(1R)-1-(2-chlorophenyl)ethyl]carbamate
SMILESC[C@@H](NC(=O)Oc1ccccc1)c1ccccc1Cl
InChIInChI=1S/C15H14ClNO2/c1-11(13-9-5-6-10-14(13)16)17-15(18)19-12-7-3-2-4-8-12/h2-11H,1H3,(H,17,18)/t11-/m1/s1
InChIKeyAOKJZWQULWLLOF-LLVKDONJSA-N
MW275.74 g/mol
LogP4.19
Rot. Bonds3

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

phenyl N-[(1R)-1-(2-chlorophenyl)ethyl]carbamate (PubChem CID 81378918) has the molecular formula C15H14ClNO2 and a molecular weight of 275.74 g/mol. Its IUPAC name is phenyl N-[(1R)-1-(2-chlorophenyl)ethyl]carbamate.

Molecular Properties

Compound Namephenyl N-[(1R)-1-(2-chlorophenyl)ethyl]carbamate
PubChem CID81378918
Molecular FormulaC15H14ClNO2
Molecular Weight275.74 g/mol
Exact Mass275.07
IUPAC Namephenyl N-[(1R)-1-(2-chlorophenyl)ethyl]carbamate
SMILESC[C@@H](NC(=O)Oc1ccccc1)c1ccccc1Cl
InChIInChI=1S/C15H14ClNO2/c1-11(13-9-5-6-10-14(13)16)17-15(18)19-12-7-3-2-4-8-12/h2-11H,1H3,(H,17,18)/t11-/m1/s1
InChIKeyAOKJZWQULWLLOF-LLVKDONJSA-N
XLogP4.19
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 ≤ 54.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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2,2,2-trifluoroethyl N-[1-(2-chlorophenyl)ethyl]carbamate
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1-[(1S)-1-(2-chlorophenyl)ethyl]-3-propan-2-ylurea
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[2-[[(1R)-1-(2-chlorophenyl)ethyl]amino]-2-oxoethyl] 2-phenoxyacetate
CID 7697704
2-amino-N-[(1R)-1-(2-chlorophenyl)ethyl]propanamide
CID 81378427
phenyl N-(1-thiophen-2-ylethyl)carbamate
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phenyl N-[(1S)-1-pyridin-4-ylethyl]carbamate
CID 81409571
N-[1-(2-chlorophenyl)ethyl]-2-(methylamino)acetamide
CID 60641198
N-[1-(2-chlorophenyl)ethyl]-3-methylbutanamide
CID 78773468
2-amino-N-[(1S)-1-(2-chlorophenyl)ethyl]acetamide
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Frequently Asked Questions

What is the IUPAC name of phenyl N-[(1R)-1-(2-chlorophenyl)ethyl]carbamate?
The IUPAC name of phenyl N-[(1R)-1-(2-chlorophenyl)ethyl]carbamate (CID 81378918) is phenyl N-[(1R)-1-(2-chlorophenyl)ethyl]carbamate.
What is the SMILES notation for phenyl N-[(1R)-1-(2-chlorophenyl)ethyl]carbamate?
The canonical SMILES for phenyl N-[(1R)-1-(2-chlorophenyl)ethyl]carbamate is C[C@@H](NC(=O)Oc1ccccc1)c1ccccc1Cl.
What is the InChIKey of phenyl N-[(1R)-1-(2-chlorophenyl)ethyl]carbamate?
The InChIKey is AOKJZWQULWLLOF-LLVKDONJSA-N. The full InChI is InChI=1S/C15H14ClNO2/c1-11(13-9-5-6-10-14(13)16)17-15(18)19-12-7-3-2-4-8-12/h2-11H,1H3,(H,17,18)/t11-/m1/s1.
What are the key properties of phenyl N-[(1R)-1-(2-chlorophenyl)ethyl]carbamate?
phenyl N-[(1R)-1-(2-chlorophenyl)ethyl]carbamate has a molecular weight of 275.74 g/mol, XLogP of 4.19, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for phenyl N-[(1R)-1-(2-chlorophenyl)ethyl]carbamate is sourced from PubChem (CID 81378918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).