2-amino-5-methoxy-N-[(3-methyl-2-pyridinyl)methyl]benzamide

C15H17N3O2 — CID 63304829

IUPAC2-amino-5-methoxy-N-[(3-methyl-2-pyridinyl)methyl]benzamide
SMILESCOc1ccc(N)c(C(=O)NCc2ncccc2C)c1
InChIInChI=1S/C15H17N3O2/c1-10-4-3-7-17-14(10)9-18-15(19)12-8-11(20-2)5-6-13(12)16/h3-8H,9,16H2,1-2H3,(H,18,19)
InChIKeyCYBNDZLANNWKIL-UHFFFAOYSA-N
MW271.32 g/mol
LogP1.91
Rot. Bonds4

About 2-amino-5-methoxy-N-[(3-methyl-2-pyridinyl)methyl]benzamide

2-amino-5-methoxy-N-[(3-methyl-2-pyridinyl)methyl]benzamide (PubChem CID 63304829) has the molecular formula C15H17N3O2 and a molecular weight of 271.32 g/mol. Its IUPAC name is 2-amino-5-methoxy-N-[(3-methyl-2-pyridinyl)methyl]benzamide.

Molecular Properties

Compound Name2-amino-5-methoxy-N-[(3-methyl-2-pyridinyl)methyl]benzamide
PubChem CID63304829
Molecular FormulaC15H17N3O2
Molecular Weight271.32 g/mol
Exact Mass271.13
IUPAC Name2-amino-5-methoxy-N-[(3-methyl-2-pyridinyl)methyl]benzamide
SMILESCOc1ccc(N)c(C(=O)NCc2ncccc2C)c1
InChIInChI=1S/C15H17N3O2/c1-10-4-3-7-17-14(10)9-18-15(19)12-8-11(20-2)5-6-13(12)16/h3-8H,9,16H2,1-2H3,(H,18,19)
InChIKeyCYBNDZLANNWKIL-UHFFFAOYSA-N
XLogP1.91
TPSA77.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.32
LogP ≤ 51.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 2-amino-5-methoxy-N-[(3-methyl-2-pyridinyl)methyl]benzamide 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-hydroxy-5-methoxy-N-[(3-methyl-2-pyridinyl)methyl]benzamide
CID 63309154
2-amino-3,4,5-trimethoxy-N-[(3-methyl-2-pyridinyl)methyl]benzamide
CID 138006324
2-amino-5-methoxy-N-pyrimidin-2-ylbenzamide
CID 54878484
2-amino-5-[(3-methyl-2-pyridinyl)methoxy]benzoic acid
CID 107077008
2-amino-5-methoxy-N-[2-(2-methylphenyl)ethyl]benzamide
CID 79756137
2,5-dihydroxy-N-[(3-methyl-2-pyridinyl)methyl]benzamide
CID 103892445
4-bromo-N-[(3-methyl-2-pyridinyl)methyl]-2-sulfanylbenzamide
CID 107029696
2-chloro-N-[(3-methyl-2-pyridinyl)methyl]pyridine-3-carboxamide
CID 63306526
4-fluoro-2-methyl-N-[(3-methyl-2-pyridinyl)methyl]benzamide
CID 113268641
2-amino-5-methoxy-N-propylbenzamide
CID 60954595
2-amino-N-(2-hydroxyethyl)-5-methoxybenzamide
CID 60954479
2-bromo-N-[(3-methyl-2-pyridinyl)methyl]-5-sulfanylbenzamide
CID 107029690

Frequently Asked Questions

What is the IUPAC name of 2-amino-5-methoxy-N-[(3-methyl-2-pyridinyl)methyl]benzamide?
The IUPAC name of 2-amino-5-methoxy-N-[(3-methyl-2-pyridinyl)methyl]benzamide (CID 63304829) is 2-amino-5-methoxy-N-[(3-methyl-2-pyridinyl)methyl]benzamide.
What is the SMILES notation for 2-amino-5-methoxy-N-[(3-methyl-2-pyridinyl)methyl]benzamide?
The canonical SMILES for 2-amino-5-methoxy-N-[(3-methyl-2-pyridinyl)methyl]benzamide is COc1ccc(N)c(C(=O)NCc2ncccc2C)c1.
What is the InChIKey of 2-amino-5-methoxy-N-[(3-methyl-2-pyridinyl)methyl]benzamide?
The InChIKey is CYBNDZLANNWKIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O2/c1-10-4-3-7-17-14(10)9-18-15(19)12-8-11(20-2)5-6-13(12)16/h3-8H,9,16H2,1-2H3,(H,18,19).
What are the key properties of 2-amino-5-methoxy-N-[(3-methyl-2-pyridinyl)methyl]benzamide?
2-amino-5-methoxy-N-[(3-methyl-2-pyridinyl)methyl]benzamide has a molecular weight of 271.32 g/mol, XLogP of 1.91, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5-methoxy-N-[(3-methyl-2-pyridinyl)methyl]benzamide is sourced from PubChem (CID 63304829), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).