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

C15H17N3O3 — CID 81394679

IUPAC2-amino-6-methoxy-N-[(2-methoxy-4-pyridinyl)methyl]benzamide
SMILESCOc1cc(CNC(=O)c2c(N)cccc2OC)ccn1
InChIInChI=1S/C15H17N3O3/c1-20-12-5-3-4-11(16)14(12)15(19)18-9-10-6-7-17-13(8-10)21-2/h3-8H,9,16H2,1-2H3,(H,18,19)
InChIKeyYJSLRUQWKUWMJW-UHFFFAOYSA-N
MW287.32 g/mol
LogP1.61
Rot. Bonds5

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

2-amino-6-methoxy-N-[(2-methoxy-4-pyridinyl)methyl]benzamide (PubChem CID 81394679) has the molecular formula C15H17N3O3 and a molecular weight of 287.32 g/mol. Its IUPAC name is 2-amino-6-methoxy-N-[(2-methoxy-4-pyridinyl)methyl]benzamide.

Molecular Properties

Compound Name2-amino-6-methoxy-N-[(2-methoxy-4-pyridinyl)methyl]benzamide
PubChem CID81394679
Molecular FormulaC15H17N3O3
Molecular Weight287.32 g/mol
Exact Mass287.13
IUPAC Name2-amino-6-methoxy-N-[(2-methoxy-4-pyridinyl)methyl]benzamide
SMILESCOc1cc(CNC(=O)c2c(N)cccc2OC)ccn1
InChIInChI=1S/C15H17N3O3/c1-20-12-5-3-4-11(16)14(12)15(19)18-9-10-6-7-17-13(8-10)21-2/h3-8H,9,16H2,1-2H3,(H,18,19)
InChIKeyYJSLRUQWKUWMJW-UHFFFAOYSA-N
XLogP1.61
TPSA86.47 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.32
LogP ≤ 51.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

2-amino-N-[(2-methoxy-4-pyridinyl)methyl]-6-methylbenzamide
CID 62990733
2-amino-6-methoxy-N-[(6-methoxy-3-pyridinyl)methyl]benzamide
CID 81394680
3-amino-N-[(2-methoxy-4-pyridinyl)methyl]benzamide
CID 62072661
4-methoxy-N-[(2-methoxy-4-pyridinyl)methyl]naphthalene-1-carboxamide
CID 18277956
4-amino-N-[(2-methoxy-4-pyridinyl)methyl]pyridine-2-carboxamide
CID 62991134
4-amino-N-[(2-methoxy-4-pyridinyl)methyl]-6-methylpyridine-3-carboxamide
CID 81242051
4-amino-3,5-dichloro-N-[(2-methoxy-4-pyridinyl)methyl]benzamide
CID 82783281
6-amino-N-[(2-methoxy-4-pyridinyl)methyl]pyridine-3-carboxamide
CID 62073001
N-[(2-methoxy-4-pyridinyl)methyl]pyridine-4-carboxamide
CID 47142420
3-fluoro-2-hydrazinyl-N-[(2-methoxy-4-pyridinyl)methyl]benzamide
CID 62989936
5-amino-2-bromo-N-[(2-methoxy-4-pyridinyl)methyl]benzamide
CID 62990194
2-amino-6-methoxy-N-[(1-methylimidazol-2-yl)methyl]benzamide
CID 81420117

Frequently Asked Questions

What is the IUPAC name of 2-amino-6-methoxy-N-[(2-methoxy-4-pyridinyl)methyl]benzamide?
The IUPAC name of 2-amino-6-methoxy-N-[(2-methoxy-4-pyridinyl)methyl]benzamide (CID 81394679) is 2-amino-6-methoxy-N-[(2-methoxy-4-pyridinyl)methyl]benzamide.
What is the SMILES notation for 2-amino-6-methoxy-N-[(2-methoxy-4-pyridinyl)methyl]benzamide?
The canonical SMILES for 2-amino-6-methoxy-N-[(2-methoxy-4-pyridinyl)methyl]benzamide is COc1cc(CNC(=O)c2c(N)cccc2OC)ccn1.
What is the InChIKey of 2-amino-6-methoxy-N-[(2-methoxy-4-pyridinyl)methyl]benzamide?
The InChIKey is YJSLRUQWKUWMJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O3/c1-20-12-5-3-4-11(16)14(12)15(19)18-9-10-6-7-17-13(8-10)21-2/h3-8H,9,16H2,1-2H3,(H,18,19).
What are the key properties of 2-amino-6-methoxy-N-[(2-methoxy-4-pyridinyl)methyl]benzamide?
2-amino-6-methoxy-N-[(2-methoxy-4-pyridinyl)methyl]benzamide has a molecular weight of 287.32 g/mol, XLogP of 1.61, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-6-methoxy-N-[(2-methoxy-4-pyridinyl)methyl]benzamide is sourced from PubChem (CID 81394679), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).