(2-methoxyphenyl) N-(4-chlorophenyl)carbamate

C14H12ClNO3 — CID 730356

IUPAC(2-methoxyphenyl) N-(4-chlorophenyl)carbamate
SMILESCOc1ccccc1OC(=O)Nc1ccc(Cl)cc1
InChIInChI=1S/C14H12ClNO3/c1-18-12-4-2-3-5-13(12)19-14(17)16-11-8-6-10(15)7-9-11/h2-9H,1H3,(H,16,17)
InChIKeyDDXBWLROOGVYFB-UHFFFAOYSA-N
MW277.71 g/mol
LogP3.96
Rot. Bonds3

About (2-methoxyphenyl) N-(4-chlorophenyl)carbamate

(2-methoxyphenyl) N-(4-chlorophenyl)carbamate (PubChem CID 730356) has the molecular formula C14H12ClNO3 and a molecular weight of 277.71 g/mol. Its IUPAC name is (2-methoxyphenyl) N-(4-chlorophenyl)carbamate.

Molecular Properties

Compound Name(2-methoxyphenyl) N-(4-chlorophenyl)carbamate
PubChem CID730356
Molecular FormulaC14H12ClNO3
Molecular Weight277.71 g/mol
Exact Mass277.05
IUPAC Name(2-methoxyphenyl) N-(4-chlorophenyl)carbamate
SMILESCOc1ccccc1OC(=O)Nc1ccc(Cl)cc1
InChIInChI=1S/C14H12ClNO3/c1-18-12-4-2-3-5-13(12)19-14(17)16-11-8-6-10(15)7-9-11/h2-9H,1H3,(H,16,17)
InChIKeyDDXBWLROOGVYFB-UHFFFAOYSA-N
XLogP3.96
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.71
LogP ≤ 53.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

Phenyl N-(4-chlorophenyl)carbamate
CID 186645
Mls002693844
CID 252028
p-Methyoxyphenol carbanilate
CID 29508
Phenyl N-(P-anisyl)carbamate
CID 230348
1-(4-Chlorophenyl)-3-(4-methoxyphenyl)urea
CID 295294
Phenyl (3-chloro-4-methoxyphenyl)carbamate
CID 731707
Phenyl N-phenylcarbamate
CID 78644
4-Chlorophenyl phenylcarbamate
CID 292622
Phenyl N-(3-chlorophenyl)carbamate
CID 232110
2-Chlorophenyl N-(3,4-dichlorophenyl)carbamate
CID 342483
2-Phenoxyethyl (3-chlorophenyl)carbamate
CID 2244782
2,4,6-Trichlorophenyl N-phenylcarbamate
CID 302825

Frequently Asked Questions

What is the IUPAC name of (2-methoxyphenyl) N-(4-chlorophenyl)carbamate?
The IUPAC name of (2-methoxyphenyl) N-(4-chlorophenyl)carbamate (CID 730356) is (2-methoxyphenyl) N-(4-chlorophenyl)carbamate.
What is the SMILES notation for (2-methoxyphenyl) N-(4-chlorophenyl)carbamate?
The canonical SMILES for (2-methoxyphenyl) N-(4-chlorophenyl)carbamate is COc1ccccc1OC(=O)Nc1ccc(Cl)cc1.
What is the InChIKey of (2-methoxyphenyl) N-(4-chlorophenyl)carbamate?
The InChIKey is DDXBWLROOGVYFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12ClNO3/c1-18-12-4-2-3-5-13(12)19-14(17)16-11-8-6-10(15)7-9-11/h2-9H,1H3,(H,16,17).
What are the key properties of (2-methoxyphenyl) N-(4-chlorophenyl)carbamate?
(2-methoxyphenyl) N-(4-chlorophenyl)carbamate has a molecular weight of 277.71 g/mol, XLogP of 3.96, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methoxyphenyl) N-(4-chlorophenyl)carbamate is sourced from PubChem (CID 730356), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).