4-amino-N-(2-methoxyphenyl)benzamide

C14H14N2O2 — CID 2317363

IUPAC4-amino-N-(2-methoxyphenyl)benzamide
SMILESCOc1ccccc1NC(=O)c1ccc(N)cc1
InChIInChI=1S/C14H14N2O2/c1-18-13-5-3-2-4-12(13)16-14(17)10-6-8-11(15)9-7-10/h2-9H,15H2,1H3,(H,16,17)
InChIKeyDCVSWMVFHSQIJJ-UHFFFAOYSA-N
MW242.28 g/mol
LogP2.53
Rot. Bonds3

About 4-amino-N-(2-methoxyphenyl)benzamide

4-amino-N-(2-methoxyphenyl)benzamide (PubChem CID 2317363) has the molecular formula C14H14N2O2 and a molecular weight of 242.28 g/mol. Its IUPAC name is 4-amino-N-(2-methoxyphenyl)benzamide.

Molecular Properties

Compound Name4-amino-N-(2-methoxyphenyl)benzamide
PubChem CID2317363
Molecular FormulaC14H14N2O2
Molecular Weight242.28 g/mol
Exact Mass242.11
IUPAC Name4-amino-N-(2-methoxyphenyl)benzamide
SMILESCOc1ccccc1NC(=O)c1ccc(N)cc1
InChIInChI=1S/C14H14N2O2/c1-18-13-5-3-2-4-12(13)16-14(17)10-6-8-11(15)9-7-10/h2-9H,15H2,1H3,(H,16,17)
InChIKeyDCVSWMVFHSQIJJ-UHFFFAOYSA-N
XLogP2.53
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.28
LogP ≤ 52.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(2-methoxyphenyl)benzamide?
The IUPAC name of 4-amino-N-(2-methoxyphenyl)benzamide (CID 2317363) is 4-amino-N-(2-methoxyphenyl)benzamide.
What is the SMILES notation for 4-amino-N-(2-methoxyphenyl)benzamide?
The canonical SMILES for 4-amino-N-(2-methoxyphenyl)benzamide is COc1ccccc1NC(=O)c1ccc(N)cc1.
What is the InChIKey of 4-amino-N-(2-methoxyphenyl)benzamide?
The InChIKey is DCVSWMVFHSQIJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O2/c1-18-13-5-3-2-4-12(13)16-14(17)10-6-8-11(15)9-7-10/h2-9H,15H2,1H3,(H,16,17).
What are the key properties of 4-amino-N-(2-methoxyphenyl)benzamide?
4-amino-N-(2-methoxyphenyl)benzamide has a molecular weight of 242.28 g/mol, XLogP of 2.53, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(2-methoxyphenyl)benzamide is sourced from PubChem (CID 2317363), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).