2-amino-N-(3-carbamoylphenyl)-4-methoxybenzamide

C15H15N3O3 — CID 115412996

IUPAC2-amino-N-(3-carbamoylphenyl)-4-methoxybenzamide
SMILESCOc1ccc(C(=O)Nc2cccc(C(N)=O)c2)c(N)c1
InChIInChI=1S/C15H15N3O3/c1-21-11-5-6-12(13(16)8-11)15(20)18-10-4-2-3-9(7-10)14(17)19/h2-8H,16H2,1H3,(H2,17,19)(H,18,20)
InChIKeyIJCXSXDBKKZLSL-UHFFFAOYSA-N
MW285.30 g/mol
LogP1.63
Rot. Bonds4

About 2-amino-N-(3-carbamoylphenyl)-4-methoxybenzamide

2-amino-N-(3-carbamoylphenyl)-4-methoxybenzamide (PubChem CID 115412996) has the molecular formula C15H15N3O3 and a molecular weight of 285.30 g/mol. Its IUPAC name is 2-amino-N-(3-carbamoylphenyl)-4-methoxybenzamide.

Molecular Properties

Compound Name2-amino-N-(3-carbamoylphenyl)-4-methoxybenzamide
PubChem CID115412996
Molecular FormulaC15H15N3O3
Molecular Weight285.30 g/mol
Exact Mass285.11
IUPAC Name2-amino-N-(3-carbamoylphenyl)-4-methoxybenzamide
SMILESCOc1ccc(C(=O)Nc2cccc(C(N)=O)c2)c(N)c1
InChIInChI=1S/C15H15N3O3/c1-21-11-5-6-12(13(16)8-11)15(20)18-10-4-2-3-9(7-10)14(17)19/h2-8H,16H2,1H3,(H2,17,19)(H,18,20)
InChIKeyIJCXSXDBKKZLSL-UHFFFAOYSA-N
XLogP1.63
TPSA107.44 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.30
LogP ≤ 51.63
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-(3-acetamidophenyl)-2-amino-4-methoxybenzamide
CID 82546305
2-amino-4-methoxy-N-(3-propan-2-ylphenyl)benzamide
CID 115412483
2-amino-N-(3-carbamoylphenyl)benzamide
CID 43402945
N-(3-carbamothioylphenyl)-2-hydroxy-4-methoxybenzamide
CID 29032119
2-amino-N-(4-fluorophenyl)-4-methoxybenzamide
CID 82547001
3-[(4-methoxyphenyl)carbamoylamino]benzamide
CID 572736
2-amino-4-methoxy-N-pyrimidin-5-ylbenzamide
CID 107588666
2-amino-N-(2,6-dichlorophenyl)-4-methoxybenzamide
CID 110451620
3-[(2,4-dimethoxybenzoyl)amino]benzoate
CID 7375040
3-(carbamoylamino)-N-(3-methoxyphenyl)benzamide
CID 29199856
4-amino-N-(3-methoxyphenyl)-2,3-dimethylbenzamide
CID 68975139
2-amino-N-(3-chloro-4-fluorophenyl)-4-methoxybenzamide
CID 80504103

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(3-carbamoylphenyl)-4-methoxybenzamide?
The IUPAC name of 2-amino-N-(3-carbamoylphenyl)-4-methoxybenzamide (CID 115412996) is 2-amino-N-(3-carbamoylphenyl)-4-methoxybenzamide.
What is the SMILES notation for 2-amino-N-(3-carbamoylphenyl)-4-methoxybenzamide?
The canonical SMILES for 2-amino-N-(3-carbamoylphenyl)-4-methoxybenzamide is COc1ccc(C(=O)Nc2cccc(C(N)=O)c2)c(N)c1.
What is the InChIKey of 2-amino-N-(3-carbamoylphenyl)-4-methoxybenzamide?
The InChIKey is IJCXSXDBKKZLSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3O3/c1-21-11-5-6-12(13(16)8-11)15(20)18-10-4-2-3-9(7-10)14(17)19/h2-8H,16H2,1H3,(H2,17,19)(H,18,20).
What are the key properties of 2-amino-N-(3-carbamoylphenyl)-4-methoxybenzamide?
2-amino-N-(3-carbamoylphenyl)-4-methoxybenzamide has a molecular weight of 285.30 g/mol, XLogP of 1.63, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(3-carbamoylphenyl)-4-methoxybenzamide is sourced from PubChem (CID 115412996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).