3-methoxy-N-phenylbenzamide

C14H13NO2 — CID 835330

IUPAC3-methoxy-N-phenylbenzamide
SMILESCOc1cccc(C(=O)Nc2ccccc2)c1
InChIInChI=1S/C14H13NO2/c1-17-13-9-5-6-11(10-13)14(16)15-12-7-3-2-4-8-12/h2-10H,1H3,(H,15,16)
InChIKeyOAAVWHUTJIJKOU-UHFFFAOYSA-N
MW227.26 g/mol
LogP2.95
Rot. Bonds3

About 3-methoxy-N-phenylbenzamide

3-methoxy-N-phenylbenzamide (PubChem CID 835330) has the molecular formula C14H13NO2 and a molecular weight of 227.26 g/mol. Its IUPAC name is 3-methoxy-N-phenylbenzamide.

Molecular Properties

Compound Name3-methoxy-N-phenylbenzamide
PubChem CID835330
Molecular FormulaC14H13NO2
Molecular Weight227.26 g/mol
Exact Mass227.09
IUPAC Name3-methoxy-N-phenylbenzamide
SMILESCOc1cccc(C(=O)Nc2ccccc2)c1
InChIInChI=1S/C14H13NO2/c1-17-13-9-5-6-11(10-13)14(16)15-12-7-3-2-4-8-12/h2-10H,1H3,(H,15,16)
InChIKeyOAAVWHUTJIJKOU-UHFFFAOYSA-N
XLogP2.95
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.26
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-methoxy-N-phenylbenzamide?
The IUPAC name of 3-methoxy-N-phenylbenzamide (CID 835330) is 3-methoxy-N-phenylbenzamide.
What is the SMILES notation for 3-methoxy-N-phenylbenzamide?
The canonical SMILES for 3-methoxy-N-phenylbenzamide is COc1cccc(C(=O)Nc2ccccc2)c1.
What is the InChIKey of 3-methoxy-N-phenylbenzamide?
The InChIKey is OAAVWHUTJIJKOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13NO2/c1-17-13-9-5-6-11(10-13)14(16)15-12-7-3-2-4-8-12/h2-10H,1H3,(H,15,16).
What are the key properties of 3-methoxy-N-phenylbenzamide?
3-methoxy-N-phenylbenzamide has a molecular weight of 227.26 g/mol, XLogP of 2.95, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-N-phenylbenzamide is sourced from PubChem (CID 835330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).