[2-[(4-fluorophenyl)methyl]phenyl] carbamate

C14H12FNO2 — CID 68973368

IUPAC[2-[(4-fluorophenyl)methyl]phenyl] carbamate
SMILESNC(=O)Oc1ccccc1Cc1ccc(F)cc1
InChIInChI=1S/C14H12FNO2/c15-12-7-5-10(6-8-12)9-11-3-1-2-4-13(11)18-14(16)17/h1-8H,9H2,(H2,16,17)
InChIKeyFPRGZWGBYXOECF-UHFFFAOYSA-N
MW245.25 g/mol
LogP2.87
Rot. Bonds3

About [2-[(4-fluorophenyl)methyl]phenyl] carbamate

[2-[(4-fluorophenyl)methyl]phenyl] carbamate (PubChem CID 68973368) has the molecular formula C14H12FNO2 and a molecular weight of 245.25 g/mol. Its IUPAC name is [2-[(4-fluorophenyl)methyl]phenyl] carbamate.

Molecular Properties

Compound Name[2-[(4-fluorophenyl)methyl]phenyl] carbamate
PubChem CID68973368
Molecular FormulaC14H12FNO2
Molecular Weight245.25 g/mol
Exact Mass245.09
IUPAC Name[2-[(4-fluorophenyl)methyl]phenyl] carbamate
SMILESNC(=O)Oc1ccccc1Cc1ccc(F)cc1
InChIInChI=1S/C14H12FNO2/c15-12-7-5-10(6-8-12)9-11-3-1-2-4-13(11)18-14(16)17/h1-8H,9H2,(H2,16,17)
InChIKeyFPRGZWGBYXOECF-UHFFFAOYSA-N
XLogP2.87
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.25
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze [2-[(4-fluorophenyl)methyl]phenyl] carbamate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of [2-[(4-fluorophenyl)methyl]phenyl] carbamate?
The IUPAC name of [2-[(4-fluorophenyl)methyl]phenyl] carbamate (CID 68973368) is [2-[(4-fluorophenyl)methyl]phenyl] carbamate.
What is the SMILES notation for [2-[(4-fluorophenyl)methyl]phenyl] carbamate?
The canonical SMILES for [2-[(4-fluorophenyl)methyl]phenyl] carbamate is NC(=O)Oc1ccccc1Cc1ccc(F)cc1.
What is the InChIKey of [2-[(4-fluorophenyl)methyl]phenyl] carbamate?
The InChIKey is FPRGZWGBYXOECF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12FNO2/c15-12-7-5-10(6-8-12)9-11-3-1-2-4-13(11)18-14(16)17/h1-8H,9H2,(H2,16,17).
What are the key properties of [2-[(4-fluorophenyl)methyl]phenyl] carbamate?
[2-[(4-fluorophenyl)methyl]phenyl] carbamate has a molecular weight of 245.25 g/mol, XLogP of 2.87, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(4-fluorophenyl)methyl]phenyl] carbamate is sourced from PubChem (CID 68973368), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).