phenyl N-(2,6-difluoro-3-methylphenyl)carbamate

C14H11F2NO2 — CID 82820468

IUPACphenyl N-(2,6-difluoro-3-methylphenyl)carbamate
SMILESCc1ccc(F)c(NC(=O)Oc2ccccc2)c1F
InChIInChI=1S/C14H11F2NO2/c1-9-7-8-11(15)13(12(9)16)17-14(18)19-10-5-3-2-4-6-10/h2-8H,1H3,(H,17,18)
InChIKeyFLZUVMBZZHNHOO-UHFFFAOYSA-N
MW263.24 g/mol
LogP3.88
Rot. Bonds2

About phenyl N-(2,6-difluoro-3-methylphenyl)carbamate

phenyl N-(2,6-difluoro-3-methylphenyl)carbamate (PubChem CID 82820468) has the molecular formula C14H11F2NO2 and a molecular weight of 263.24 g/mol. Its IUPAC name is phenyl N-(2,6-difluoro-3-methylphenyl)carbamate.

Molecular Properties

Compound Namephenyl N-(2,6-difluoro-3-methylphenyl)carbamate
PubChem CID82820468
Molecular FormulaC14H11F2NO2
Molecular Weight263.24 g/mol
Exact Mass263.08
IUPAC Namephenyl N-(2,6-difluoro-3-methylphenyl)carbamate
SMILESCc1ccc(F)c(NC(=O)Oc2ccccc2)c1F
InChIInChI=1S/C14H11F2NO2/c1-9-7-8-11(15)13(12(9)16)17-14(18)19-10-5-3-2-4-6-10/h2-8H,1H3,(H,17,18)
InChIKeyFLZUVMBZZHNHOO-UHFFFAOYSA-N
XLogP3.88
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.24
LogP ≤ 53.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze phenyl N-(2,6-difluoro-3-methylphenyl)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

phenyl N-(2,6-difluorophenyl)carbamate
CID 60631299
phenyl N-(2-fluorophenyl)carbamate
CID 3790948
phenyl N-(4-chloro-2-fluoro-5-methylphenyl)carbamate
CID 18615647
3-(2,6-difluoro-3-methylanilino)-3-oxopropanoic acid
CID 82820377
methyl 3-[3-fluoro-2-(phenoxycarbonylamino)phenyl]prop-2-enoate
CID 123900615
phenyl N-[5-(fluorooxycarbonylamino)-2-methylphenyl]carbamate
CID 66804164
phenyl N-(2,3,5-trifluorophenyl)carbamate
CID 64592474
phenyl N-(4-chloro-6-fluoro-3-methyl-2-nitrophenyl)carbamate
CID 18615646
phenyl N-[5-fluoro-2,4-di(propan-2-yl)-3-pyridinyl]carbamate
CID 146571327
phenyl N-(5-amino-2-fluorophenyl)carbamate
CID 43602338
phenyl N-(5-ethoxy-2-fluoro-4-methylphenyl)carbamate
CID 164584343
3-amino-N-(2,6-difluoro-3-methylphenyl)-3-phenylpropanamide
CID 82801709

Frequently Asked Questions

What is the IUPAC name of phenyl N-(2,6-difluoro-3-methylphenyl)carbamate?
The IUPAC name of phenyl N-(2,6-difluoro-3-methylphenyl)carbamate (CID 82820468) is phenyl N-(2,6-difluoro-3-methylphenyl)carbamate.
What is the SMILES notation for phenyl N-(2,6-difluoro-3-methylphenyl)carbamate?
The canonical SMILES for phenyl N-(2,6-difluoro-3-methylphenyl)carbamate is Cc1ccc(F)c(NC(=O)Oc2ccccc2)c1F.
What is the InChIKey of phenyl N-(2,6-difluoro-3-methylphenyl)carbamate?
The InChIKey is FLZUVMBZZHNHOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11F2NO2/c1-9-7-8-11(15)13(12(9)16)17-14(18)19-10-5-3-2-4-6-10/h2-8H,1H3,(H,17,18).
What are the key properties of phenyl N-(2,6-difluoro-3-methylphenyl)carbamate?
phenyl N-(2,6-difluoro-3-methylphenyl)carbamate has a molecular weight of 263.24 g/mol, XLogP of 3.88, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for phenyl N-(2,6-difluoro-3-methylphenyl)carbamate is sourced from PubChem (CID 82820468), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).