phenyl N-(2-fluorophenyl)carbamate

C13H10FNO2 — CID 3790948

IUPACphenyl N-(2-fluorophenyl)carbamate
SMILESO=C(Nc1ccccc1F)Oc1ccccc1
InChIInChI=1S/C13H10FNO2/c14-11-8-4-5-9-12(11)15-13(16)17-10-6-2-1-3-7-10/h1-9H,(H,15,16)
InChIKeyPMTBCKBKVIIQEL-UHFFFAOYSA-N
MW231.23 g/mol
LogP3.44
Rot. Bonds2

About phenyl N-(2-fluorophenyl)carbamate

phenyl N-(2-fluorophenyl)carbamate (PubChem CID 3790948) has the molecular formula C13H10FNO2 and a molecular weight of 231.23 g/mol. Its IUPAC name is phenyl N-(2-fluorophenyl)carbamate.

Molecular Properties

Compound Namephenyl N-(2-fluorophenyl)carbamate
PubChem CID3790948
Molecular FormulaC13H10FNO2
Molecular Weight231.23 g/mol
Exact Mass231.07
IUPAC Namephenyl N-(2-fluorophenyl)carbamate
SMILESO=C(Nc1ccccc1F)Oc1ccccc1
InChIInChI=1S/C13H10FNO2/c14-11-8-4-5-9-12(11)15-13(16)17-10-6-2-1-3-7-10/h1-9H,(H,15,16)
InChIKeyPMTBCKBKVIIQEL-UHFFFAOYSA-N
XLogP3.44
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.23
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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phenyl N-(5-bromo-4-chloro-2-fluorophenyl)carbamate
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phenyl N-(2-bromo-4-methylphenyl)carbamate
CID 3453949
phenyl N-(2,6-difluoro-3-methylphenyl)carbamate
CID 82820468
phenyl N-[2-fluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]carbamate
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Frequently Asked Questions

What is the IUPAC name of phenyl N-(2-fluorophenyl)carbamate?
The IUPAC name of phenyl N-(2-fluorophenyl)carbamate (CID 3790948) is phenyl N-(2-fluorophenyl)carbamate.
What is the SMILES notation for phenyl N-(2-fluorophenyl)carbamate?
The canonical SMILES for phenyl N-(2-fluorophenyl)carbamate is O=C(Nc1ccccc1F)Oc1ccccc1.
What is the InChIKey of phenyl N-(2-fluorophenyl)carbamate?
The InChIKey is PMTBCKBKVIIQEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10FNO2/c14-11-8-4-5-9-12(11)15-13(16)17-10-6-2-1-3-7-10/h1-9H,(H,15,16).
What are the key properties of phenyl N-(2-fluorophenyl)carbamate?
phenyl N-(2-fluorophenyl)carbamate has a molecular weight of 231.23 g/mol, XLogP of 3.44, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for phenyl N-(2-fluorophenyl)carbamate is sourced from PubChem (CID 3790948), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).