phenyl N-[(2-methoxyphenyl)methyl]carbamate

C15H15NO3 — CID 19711159

IUPACphenyl N-[(2-methoxyphenyl)methyl]carbamate
SMILESCOc1ccccc1CNC(=O)Oc1ccccc1
InChIInChI=1S/C15H15NO3/c1-18-14-10-6-5-7-12(14)11-16-15(17)19-13-8-3-2-4-9-13/h2-10H,11H2,1H3,(H,16,17)
InChIKeyUDUWEAUJPVPJPS-UHFFFAOYSA-N
MW257.29 g/mol
LogP2.98
Rot. Bonds4

About phenyl N-[(2-methoxyphenyl)methyl]carbamate

phenyl N-[(2-methoxyphenyl)methyl]carbamate (PubChem CID 19711159) has the molecular formula C15H15NO3 and a molecular weight of 257.29 g/mol. Its IUPAC name is phenyl N-[(2-methoxyphenyl)methyl]carbamate.

Molecular Properties

Compound Namephenyl N-[(2-methoxyphenyl)methyl]carbamate
PubChem CID19711159
Molecular FormulaC15H15NO3
Molecular Weight257.29 g/mol
Exact Mass257.11
IUPAC Namephenyl N-[(2-methoxyphenyl)methyl]carbamate
SMILESCOc1ccccc1CNC(=O)Oc1ccccc1
InChIInChI=1S/C15H15NO3/c1-18-14-10-6-5-7-12(14)11-16-15(17)19-13-8-3-2-4-9-13/h2-10H,11H2,1H3,(H,16,17)
InChIKeyUDUWEAUJPVPJPS-UHFFFAOYSA-N
XLogP2.98
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.29
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of phenyl N-[(2-methoxyphenyl)methyl]carbamate?
The IUPAC name of phenyl N-[(2-methoxyphenyl)methyl]carbamate (CID 19711159) is phenyl N-[(2-methoxyphenyl)methyl]carbamate.
What is the SMILES notation for phenyl N-[(2-methoxyphenyl)methyl]carbamate?
The canonical SMILES for phenyl N-[(2-methoxyphenyl)methyl]carbamate is COc1ccccc1CNC(=O)Oc1ccccc1.
What is the InChIKey of phenyl N-[(2-methoxyphenyl)methyl]carbamate?
The InChIKey is UDUWEAUJPVPJPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15NO3/c1-18-14-10-6-5-7-12(14)11-16-15(17)19-13-8-3-2-4-9-13/h2-10H,11H2,1H3,(H,16,17).
What are the key properties of phenyl N-[(2-methoxyphenyl)methyl]carbamate?
phenyl N-[(2-methoxyphenyl)methyl]carbamate has a molecular weight of 257.29 g/mol, XLogP of 2.98, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for phenyl N-[(2-methoxyphenyl)methyl]carbamate is sourced from PubChem (CID 19711159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).