benzyl N-(2-methylphenyl)carbamate

C15H15NO2 — CID 895304

IUPACbenzyl N-(2-methylphenyl)carbamate
SMILESCc1ccccc1NC(=O)OCc1ccccc1
InChIInChI=1S/C15H15NO2/c1-12-7-5-6-10-14(12)16-15(17)18-11-13-8-3-2-4-9-13/h2-10H,11H2,1H3,(H,16,17)
InChIKeyXHJLADWDZOROLZ-UHFFFAOYSA-N
MW241.29 g/mol
LogP3.74
Rot. Bonds3

About benzyl N-(2-methylphenyl)carbamate

benzyl N-(2-methylphenyl)carbamate (PubChem CID 895304) has the molecular formula C15H15NO2 and a molecular weight of 241.29 g/mol. Its IUPAC name is benzyl N-(2-methylphenyl)carbamate.

Molecular Properties

Compound Namebenzyl N-(2-methylphenyl)carbamate
PubChem CID895304
Molecular FormulaC15H15NO2
Molecular Weight241.29 g/mol
Exact Mass241.11
IUPAC Namebenzyl N-(2-methylphenyl)carbamate
SMILESCc1ccccc1NC(=O)OCc1ccccc1
InChIInChI=1S/C15H15NO2/c1-12-7-5-6-10-14(12)16-15(17)18-11-13-8-3-2-4-9-13/h2-10H,11H2,1H3,(H,16,17)
InChIKeyXHJLADWDZOROLZ-UHFFFAOYSA-N
XLogP3.74
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.29
LogP ≤ 53.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of benzyl N-(2-methylphenyl)carbamate?
The IUPAC name of benzyl N-(2-methylphenyl)carbamate (CID 895304) is benzyl N-(2-methylphenyl)carbamate.
What is the SMILES notation for benzyl N-(2-methylphenyl)carbamate?
The canonical SMILES for benzyl N-(2-methylphenyl)carbamate is Cc1ccccc1NC(=O)OCc1ccccc1.
What is the InChIKey of benzyl N-(2-methylphenyl)carbamate?
The InChIKey is XHJLADWDZOROLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15NO2/c1-12-7-5-6-10-14(12)16-15(17)18-11-13-8-3-2-4-9-13/h2-10H,11H2,1H3,(H,16,17).
What are the key properties of benzyl N-(2-methylphenyl)carbamate?
benzyl N-(2-methylphenyl)carbamate has a molecular weight of 241.29 g/mol, XLogP of 3.74, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for benzyl N-(2-methylphenyl)carbamate is sourced from PubChem (CID 895304), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).