4-amino-N-(2,4-dimethoxyphenyl)benzamide

C15H16N2O3 — CID 8566750

IUPAC4-amino-N-(2,4-dimethoxyphenyl)benzamide
SMILESCOc1ccc(NC(=O)c2ccc(N)cc2)c(OC)c1
InChIInChI=1S/C15H16N2O3/c1-19-12-7-8-13(14(9-12)20-2)17-15(18)10-3-5-11(16)6-4-10/h3-9H,16H2,1-2H3,(H,17,18)
InChIKeyHGBNAYHZTXHRLI-UHFFFAOYSA-N
MW272.30 g/mol
LogP2.54
Rot. Bonds4

About 4-amino-N-(2,4-dimethoxyphenyl)benzamide

4-amino-N-(2,4-dimethoxyphenyl)benzamide (PubChem CID 8566750) has the molecular formula C15H16N2O3 and a molecular weight of 272.30 g/mol. Its IUPAC name is 4-amino-N-(2,4-dimethoxyphenyl)benzamide.

Molecular Properties

Compound Name4-amino-N-(2,4-dimethoxyphenyl)benzamide
PubChem CID8566750
Molecular FormulaC15H16N2O3
Molecular Weight272.30 g/mol
Exact Mass272.12
IUPAC Name4-amino-N-(2,4-dimethoxyphenyl)benzamide
SMILESCOc1ccc(NC(=O)c2ccc(N)cc2)c(OC)c1
InChIInChI=1S/C15H16N2O3/c1-19-12-7-8-13(14(9-12)20-2)17-15(18)10-3-5-11(16)6-4-10/h3-9H,16H2,1-2H3,(H,17,18)
InChIKeyHGBNAYHZTXHRLI-UHFFFAOYSA-N
XLogP2.54
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.30
LogP ≤ 52.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-(2,4-dimethoxyphenyl)-4-fluorobenzamide
CID 2832276
1-N-(2,4-dimethoxyphenyl)-4-N-propan-2-ylbenzene-1,4-dicarboxamide
CID 109043198
N-(2,4-dimethoxyphenyl)-4-phenylbenzamide
CID 602380
N-(4-amino-2-methoxyphenyl)-4-(2-methoxyethoxy)benzamide
CID 54852579
2,4-diamino-N-(2,4-dimethoxyphenyl)benzamide
CID 61089728
1-N-cyclopropyl-4-N-(2,4-dimethoxyphenyl)benzene-1,4-dicarboxamide
CID 109043393
3-acetamido-N-(2,4-dimethoxyphenyl)-4-methoxybenzamide
CID 110764309
4-(diethylamino)-N-(2,4-dimethoxyphenyl)benzamide
CID 9120164
N-(2,4-dimethoxyphenyl)-4-pyrrol-1-ylbenzamide
CID 24536376
N-(4-amino-2-methoxyphenyl)-4-methylsulfanylbenzamide
CID 79215059
4-N-butan-2-yl-1-N-(2,4-dimethoxyphenyl)benzene-1,4-dicarboxamide
CID 109044149
4-N-(2,4-dimethoxyphenyl)-1-N-[2-(dimethylamino)ethyl]benzene-1,4-dicarboxamide
CID 109045814

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(2,4-dimethoxyphenyl)benzamide?
The IUPAC name of 4-amino-N-(2,4-dimethoxyphenyl)benzamide (CID 8566750) is 4-amino-N-(2,4-dimethoxyphenyl)benzamide.
What is the SMILES notation for 4-amino-N-(2,4-dimethoxyphenyl)benzamide?
The canonical SMILES for 4-amino-N-(2,4-dimethoxyphenyl)benzamide is COc1ccc(NC(=O)c2ccc(N)cc2)c(OC)c1.
What is the InChIKey of 4-amino-N-(2,4-dimethoxyphenyl)benzamide?
The InChIKey is HGBNAYHZTXHRLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O3/c1-19-12-7-8-13(14(9-12)20-2)17-15(18)10-3-5-11(16)6-4-10/h3-9H,16H2,1-2H3,(H,17,18).
What are the key properties of 4-amino-N-(2,4-dimethoxyphenyl)benzamide?
4-amino-N-(2,4-dimethoxyphenyl)benzamide has a molecular weight of 272.30 g/mol, XLogP of 2.54, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(2,4-dimethoxyphenyl)benzamide is sourced from PubChem (CID 8566750), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).