2-[(3-aminophenyl)methyl-(6-methoxy-2-pyridinyl)amino]acetamide

C15H18N4O2 — CID 63589902

IUPAC2-[(3-aminophenyl)methyl-(6-methoxy-2-pyridinyl)amino]acetamide
SMILESCOc1cccc(N(CC(N)=O)Cc2cccc(N)c2)n1
InChIInChI=1S/C15H18N4O2/c1-21-15-7-3-6-14(18-15)19(10-13(17)20)9-11-4-2-5-12(16)8-11/h2-8H,9-10,16H2,1H3,(H2,17,20)
InChIKeyXGYQGGZADSDOMI-UHFFFAOYSA-N
MW286.34 g/mol
LogP1.16
Rot. Bonds6

About 2-[(3-aminophenyl)methyl-(6-methoxy-2-pyridinyl)amino]acetamide

2-[(3-aminophenyl)methyl-(6-methoxy-2-pyridinyl)amino]acetamide (PubChem CID 63589902) has the molecular formula C15H18N4O2 and a molecular weight of 286.34 g/mol. Its IUPAC name is 2-[(3-aminophenyl)methyl-(6-methoxy-2-pyridinyl)amino]acetamide.

Molecular Properties

Compound Name2-[(3-aminophenyl)methyl-(6-methoxy-2-pyridinyl)amino]acetamide
PubChem CID63589902
Molecular FormulaC15H18N4O2
Molecular Weight286.34 g/mol
Exact Mass286.14
IUPAC Name2-[(3-aminophenyl)methyl-(6-methoxy-2-pyridinyl)amino]acetamide
SMILESCOc1cccc(N(CC(N)=O)Cc2cccc(N)c2)n1
InChIInChI=1S/C15H18N4O2/c1-21-15-7-3-6-14(18-15)19(10-13(17)20)9-11-4-2-5-12(16)8-11/h2-8H,9-10,16H2,1H3,(H2,17,20)
InChIKeyXGYQGGZADSDOMI-UHFFFAOYSA-N
XLogP1.16
TPSA94.47 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.34
LogP ≤ 51.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze 2-[(3-aminophenyl)methyl-(6-methoxy-2-pyridinyl)amino]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[(3-aminophenyl)methyl-(5,6-dimethylpyrazin-2-yl)amino]acetamide
CID 114476656
2-[(3-aminophenyl)methyl-pyrimidin-2-ylamino]acetamide
CID 60874955
2-[(3-aminophenyl)methyl-(5-methylpyridazin-3-yl)amino]acetamide
CID 106550306
N-[(3-aminophenyl)methyl]-6-ethoxy-N-ethylpyridin-2-amine
CID 63591322
2-[(3-aminophenyl)methyl-(5-bromo-2-pyridinyl)amino]acetamide
CID 60875903
2-[(3-aminophenyl)methyl-(1-methyltetrazol-5-yl)amino]acetamide
CID 63149855
6-[(3-aminophenyl)methyl-propylamino]pyridine-2-carboxamide
CID 64589399
N-[(3-aminophenyl)methyl]-N-ethyl-6-methoxypyrimidin-4-amine
CID 66320787
2-[(3-aminophenyl)methyl-(3-fluoro-2-pyridinyl)amino]acetamide
CID 62734371
2-[(3-aminophenyl)methyl-(5-bromo-3-methyl-2-pyridinyl)amino]acetamide
CID 79713137
2-[(3-aminophenyl)methyl-methylsulfonylamino]acetamide
CID 43461206
2-[(2-amino-2-oxoethyl)-[(3-aminophenyl)methyl]amino]butanamide
CID 62899868

Frequently Asked Questions

What is the IUPAC name of 2-[(3-aminophenyl)methyl-(6-methoxy-2-pyridinyl)amino]acetamide?
The IUPAC name of 2-[(3-aminophenyl)methyl-(6-methoxy-2-pyridinyl)amino]acetamide (CID 63589902) is 2-[(3-aminophenyl)methyl-(6-methoxy-2-pyridinyl)amino]acetamide.
What is the SMILES notation for 2-[(3-aminophenyl)methyl-(6-methoxy-2-pyridinyl)amino]acetamide?
The canonical SMILES for 2-[(3-aminophenyl)methyl-(6-methoxy-2-pyridinyl)amino]acetamide is COc1cccc(N(CC(N)=O)Cc2cccc(N)c2)n1.
What is the InChIKey of 2-[(3-aminophenyl)methyl-(6-methoxy-2-pyridinyl)amino]acetamide?
The InChIKey is XGYQGGZADSDOMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4O2/c1-21-15-7-3-6-14(18-15)19(10-13(17)20)9-11-4-2-5-12(16)8-11/h2-8H,9-10,16H2,1H3,(H2,17,20).
What are the key properties of 2-[(3-aminophenyl)methyl-(6-methoxy-2-pyridinyl)amino]acetamide?
2-[(3-aminophenyl)methyl-(6-methoxy-2-pyridinyl)amino]acetamide has a molecular weight of 286.34 g/mol, XLogP of 1.16, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-aminophenyl)methyl-(6-methoxy-2-pyridinyl)amino]acetamide is sourced from PubChem (CID 63589902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).