(4-methoxy-3-phenylmethoxyphenyl)carbamic acid

C15H15NO4 — CID 155170089

IUPAC(4-methoxy-3-phenylmethoxyphenyl)carbamic acid
SMILESCOc1ccc(NC(=O)O)cc1OCc1ccccc1
InChIInChI=1S/C15H15NO4/c1-19-13-8-7-12(16-15(17)18)9-14(13)20-10-11-5-3-2-4-6-11/h2-9,16H,10H2,1H3,(H,17,18)
InChIKeyJJPWCXITBGCJFE-UHFFFAOYSA-N
MW273.29 g/mol
LogP3.36
Rot. Bonds5

About (4-methoxy-3-phenylmethoxyphenyl)carbamic acid

(4-methoxy-3-phenylmethoxyphenyl)carbamic acid (PubChem CID 155170089) has the molecular formula C15H15NO4 and a molecular weight of 273.29 g/mol. Its IUPAC name is (4-methoxy-3-phenylmethoxyphenyl)carbamic acid.

Molecular Properties

Compound Name(4-methoxy-3-phenylmethoxyphenyl)carbamic acid
PubChem CID155170089
Molecular FormulaC15H15NO4
Molecular Weight273.29 g/mol
Exact Mass273.10
IUPAC Name(4-methoxy-3-phenylmethoxyphenyl)carbamic acid
SMILESCOc1ccc(NC(=O)O)cc1OCc1ccccc1
InChIInChI=1S/C15H15NO4/c1-19-13-8-7-12(16-15(17)18)9-14(13)20-10-11-5-3-2-4-6-11/h2-9,16H,10H2,1H3,(H,17,18)
InChIKeyJJPWCXITBGCJFE-UHFFFAOYSA-N
XLogP3.36
TPSA67.79 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.29
LogP ≤ 53.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze (4-methoxy-3-phenylmethoxyphenyl)carbamic acid 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 (4-methoxy-3-phenylmethoxyphenyl)carbamic acid?
The IUPAC name of (4-methoxy-3-phenylmethoxyphenyl)carbamic acid (CID 155170089) is (4-methoxy-3-phenylmethoxyphenyl)carbamic acid.
What is the SMILES notation for (4-methoxy-3-phenylmethoxyphenyl)carbamic acid?
The canonical SMILES for (4-methoxy-3-phenylmethoxyphenyl)carbamic acid is COc1ccc(NC(=O)O)cc1OCc1ccccc1.
What is the InChIKey of (4-methoxy-3-phenylmethoxyphenyl)carbamic acid?
The InChIKey is JJPWCXITBGCJFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15NO4/c1-19-13-8-7-12(16-15(17)18)9-14(13)20-10-11-5-3-2-4-6-11/h2-9,16H,10H2,1H3,(H,17,18).
What are the key properties of (4-methoxy-3-phenylmethoxyphenyl)carbamic acid?
(4-methoxy-3-phenylmethoxyphenyl)carbamic acid has a molecular weight of 273.29 g/mol, XLogP of 3.36, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methoxy-3-phenylmethoxyphenyl)carbamic acid is sourced from PubChem (CID 155170089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).