phenyl N-(3-fluoro-4-methoxyphenyl)carbamate

C14H12FNO3 — CID 61215909

IUPACphenyl N-(3-fluoro-4-methoxyphenyl)carbamate
SMILESCOc1ccc(NC(=O)Oc2ccccc2)cc1F
InChIInChI=1S/C14H12FNO3/c1-18-13-8-7-10(9-12(13)15)16-14(17)19-11-5-3-2-4-6-11/h2-9H,1H3,(H,16,17)
InChIKeyZVDUOYINHKBWFW-UHFFFAOYSA-N
MW261.25 g/mol
LogP3.45
Rot. Bonds3

About phenyl N-(3-fluoro-4-methoxyphenyl)carbamate

phenyl N-(3-fluoro-4-methoxyphenyl)carbamate (PubChem CID 61215909) has the molecular formula C14H12FNO3 and a molecular weight of 261.25 g/mol. Its IUPAC name is phenyl N-(3-fluoro-4-methoxyphenyl)carbamate.

Molecular Properties

Compound Namephenyl N-(3-fluoro-4-methoxyphenyl)carbamate
PubChem CID61215909
Molecular FormulaC14H12FNO3
Molecular Weight261.25 g/mol
Exact Mass261.08
IUPAC Namephenyl N-(3-fluoro-4-methoxyphenyl)carbamate
SMILESCOc1ccc(NC(=O)Oc2ccccc2)cc1F
InChIInChI=1S/C14H12FNO3/c1-18-13-8-7-10(9-12(13)15)16-14(17)19-11-5-3-2-4-6-11/h2-9H,1H3,(H,16,17)
InChIKeyZVDUOYINHKBWFW-UHFFFAOYSA-N
XLogP3.45
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.25
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

phenyl N-(3-hydroxy-4-methoxyphenyl)carbamate
CID 60637496
phenyl N-(4-methoxy-3-nitrophenyl)carbamate
CID 12877201
tert-butyl N-(3-fluoro-4-methoxyphenyl)carbamate
CID 65143046
phenyl N-(3-methyl-4-phenoxyphenyl)carbamate
CID 139442804
N-(3-fluoro-4-methoxyphenyl)-2,6-dimethoxybenzamide
CID 110776470
2-[2-(3-fluoro-4-methoxyanilino)-2-oxoethyl]sulfanylacetic acid
CID 113427666
phenyl N-[5-(fluorooxycarbonylamino)-2-methylphenyl]carbamate
CID 66804164
phenyl N-[4-(methanesulfonamidomethyl)-3-methoxyphenyl]carbamate
CID 86679381
2-bromo-N-(3-fluoro-4-methoxyphenyl)-2-methylpropanamide
CID 114327553
phenyl N-(3-fluoro-4-methoxy-5-pyridin-3-ylphenyl)carbamate
CID 18005132
N-(3-fluoro-4-methoxyphenyl)-2-(4-methoxyphenyl)acetamide
CID 110776473
(3,5-dimethoxyphenyl) N-phenylcarbamate
CID 23281948

Frequently Asked Questions

What is the IUPAC name of phenyl N-(3-fluoro-4-methoxyphenyl)carbamate?
The IUPAC name of phenyl N-(3-fluoro-4-methoxyphenyl)carbamate (CID 61215909) is phenyl N-(3-fluoro-4-methoxyphenyl)carbamate.
What is the SMILES notation for phenyl N-(3-fluoro-4-methoxyphenyl)carbamate?
The canonical SMILES for phenyl N-(3-fluoro-4-methoxyphenyl)carbamate is COc1ccc(NC(=O)Oc2ccccc2)cc1F.
What is the InChIKey of phenyl N-(3-fluoro-4-methoxyphenyl)carbamate?
The InChIKey is ZVDUOYINHKBWFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12FNO3/c1-18-13-8-7-10(9-12(13)15)16-14(17)19-11-5-3-2-4-6-11/h2-9H,1H3,(H,16,17).
What are the key properties of phenyl N-(3-fluoro-4-methoxyphenyl)carbamate?
phenyl N-(3-fluoro-4-methoxyphenyl)carbamate has a molecular weight of 261.25 g/mol, XLogP of 3.45, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for phenyl N-(3-fluoro-4-methoxyphenyl)carbamate is sourced from PubChem (CID 61215909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).