4-amino-N-[2-[(6-methoxy-3-pyridinyl)amino]-2-oxoethyl]benzamide

C15H16N4O3 — CID 43822670

IUPAC4-amino-N-[2-[(6-methoxy-3-pyridinyl)amino]-2-oxoethyl]benzamide
SMILESCOc1ccc(NC(=O)CNC(=O)c2ccc(N)cc2)cn1
InChIInChI=1S/C15H16N4O3/c1-22-14-7-6-12(8-17-14)19-13(20)9-18-15(21)10-2-4-11(16)5-3-10/h2-8H,9,16H2,1H3,(H,18,21)(H,19,20)
InChIKeyJRXOGARISDFRRM-UHFFFAOYSA-N
MW300.32 g/mol
LogP1.04
Rot. Bonds5

About 4-amino-N-[2-[(6-methoxy-3-pyridinyl)amino]-2-oxoethyl]benzamide

4-amino-N-[2-[(6-methoxy-3-pyridinyl)amino]-2-oxoethyl]benzamide (PubChem CID 43822670) has the molecular formula C15H16N4O3 and a molecular weight of 300.32 g/mol. Its IUPAC name is 4-amino-N-[2-[(6-methoxy-3-pyridinyl)amino]-2-oxoethyl]benzamide.

Molecular Properties

Compound Name4-amino-N-[2-[(6-methoxy-3-pyridinyl)amino]-2-oxoethyl]benzamide
PubChem CID43822670
Molecular FormulaC15H16N4O3
Molecular Weight300.32 g/mol
Exact Mass300.12
IUPAC Name4-amino-N-[2-[(6-methoxy-3-pyridinyl)amino]-2-oxoethyl]benzamide
SMILESCOc1ccc(NC(=O)CNC(=O)c2ccc(N)cc2)cn1
InChIInChI=1S/C15H16N4O3/c1-22-14-7-6-12(8-17-14)19-13(20)9-18-15(21)10-2-4-11(16)5-3-10/h2-8H,9,16H2,1H3,(H,18,21)(H,19,20)
InChIKeyJRXOGARISDFRRM-UHFFFAOYSA-N
XLogP1.04
TPSA106.34 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.32
LogP ≤ 51.04
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

2-(cyclopropylamino)-N-(6-methoxy-3-pyridinyl)acetamide
CID 60688381
3,5-diamino-N-(6-methoxy-3-pyridinyl)benzamide
CID 61090732
2-chloro-N-(6-methoxy-3-pyridinyl)acetamide
CID 2561820
N-[2-[(6-methoxy-3-pyridinyl)amino]-2-oxoethyl]-2-naphthalen-1-ylacetamide
CID 7478533
6-amino-N-(6-methoxy-3-pyridinyl)pyridine-3-carboxamide
CID 62060168
4-amino-N-[2-(1,2-oxazol-4-ylamino)-2-oxoethyl]benzamide
CID 62902736
2-(2-aminophenyl)-N-(6-methoxy-3-pyridinyl)acetamide
CID 16795634
2-(3-aminophenyl)-N-(6-methoxy-3-pyridinyl)acetamide
CID 62499152
N-[2-(2-ethylanilino)-2-oxoethyl]-6-methoxypyridine-3-carboxamide
CID 24531875
[2-[(6-methoxy-3-pyridinyl)amino]-2-oxoethyl] (2R)-3-methyl-2-[(4-methylbenzoyl)amino]butanoate
CID 7987092
(3Z)-3-amino-3-hydroxyimino-N-(6-methoxy-3-pyridinyl)propanamide
CID 43156078
2-(3,5-dimethylphenoxy)-N-(6-methoxy-3-pyridinyl)acetamide
CID 7478526

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-[2-[(6-methoxy-3-pyridinyl)amino]-2-oxoethyl]benzamide?
The IUPAC name of 4-amino-N-[2-[(6-methoxy-3-pyridinyl)amino]-2-oxoethyl]benzamide (CID 43822670) is 4-amino-N-[2-[(6-methoxy-3-pyridinyl)amino]-2-oxoethyl]benzamide.
What is the SMILES notation for 4-amino-N-[2-[(6-methoxy-3-pyridinyl)amino]-2-oxoethyl]benzamide?
The canonical SMILES for 4-amino-N-[2-[(6-methoxy-3-pyridinyl)amino]-2-oxoethyl]benzamide is COc1ccc(NC(=O)CNC(=O)c2ccc(N)cc2)cn1.
What is the InChIKey of 4-amino-N-[2-[(6-methoxy-3-pyridinyl)amino]-2-oxoethyl]benzamide?
The InChIKey is JRXOGARISDFRRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N4O3/c1-22-14-7-6-12(8-17-14)19-13(20)9-18-15(21)10-2-4-11(16)5-3-10/h2-8H,9,16H2,1H3,(H,18,21)(H,19,20).
What are the key properties of 4-amino-N-[2-[(6-methoxy-3-pyridinyl)amino]-2-oxoethyl]benzamide?
4-amino-N-[2-[(6-methoxy-3-pyridinyl)amino]-2-oxoethyl]benzamide has a molecular weight of 300.32 g/mol, XLogP of 1.04, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-[2-[(6-methoxy-3-pyridinyl)amino]-2-oxoethyl]benzamide is sourced from PubChem (CID 43822670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).