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

C14H15N3O2 — CID 61250537

IUPAC2-amino-N-[(6-methoxy-3-pyridinyl)methyl]benzamide
SMILESCOc1ccc(CNC(=O)c2ccccc2N)cn1
InChIInChI=1S/C14H15N3O2/c1-19-13-7-6-10(8-16-13)9-17-14(18)11-4-2-3-5-12(11)15/h2-8H,9,15H2,1H3,(H,17,18)
InChIKeyVLLPZVUWWMXIGX-UHFFFAOYSA-N
MW257.29 g/mol
LogP1.60
Rot. Bonds4

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

2-amino-N-[(6-methoxy-3-pyridinyl)methyl]benzamide (PubChem CID 61250537) has the molecular formula C14H15N3O2 and a molecular weight of 257.29 g/mol. Its IUPAC name is 2-amino-N-[(6-methoxy-3-pyridinyl)methyl]benzamide.

Molecular Properties

Compound Name2-amino-N-[(6-methoxy-3-pyridinyl)methyl]benzamide
PubChem CID61250537
Molecular FormulaC14H15N3O2
Molecular Weight257.29 g/mol
Exact Mass257.12
IUPAC Name2-amino-N-[(6-methoxy-3-pyridinyl)methyl]benzamide
SMILESCOc1ccc(CNC(=O)c2ccccc2N)cn1
InChIInChI=1S/C14H15N3O2/c1-19-13-7-6-10(8-16-13)9-17-14(18)11-4-2-3-5-12(11)15/h2-8H,9,15H2,1H3,(H,17,18)
InChIKeyVLLPZVUWWMXIGX-UHFFFAOYSA-N
XLogP1.60
TPSA77.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.29
LogP ≤ 51.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-benzyl-N-[(6-methoxy-3-pyridinyl)methyl]benzamide
CID 51316857
2-amino-6-methoxy-N-[(6-methoxy-3-pyridinyl)methyl]benzamide
CID 81394680
1-N,4-N-bis[(6-methoxy-3-pyridinyl)methyl]benzene-1,4-dicarboxamide
CID 24646071
2-amino-N-[[6-(diethylamino)-3-pyridinyl]methyl]benzamide
CID 119946492
5-amino-2,3-dichloro-N-[(6-methoxy-3-pyridinyl)methyl]benzamide
CID 107185089
N-[(6-methoxy-3-pyridinyl)methyl]-4-phenylbenzamide
CID 24589971
6-amino-N-[(6-methoxy-3-pyridinyl)methyl]pyridine-3-carboxamide
CID 55152846
3-amino-N-[(6-methoxy-3-pyridinyl)methyl]-4-methylbenzamide
CID 61275557
2,5-difluoro-N-[(6-methoxy-3-pyridinyl)methyl]benzamide
CID 47136692
2,4-difluoro-N-[(6-methoxy-3-pyridinyl)methyl]benzamide
CID 47136619
3-amino-2-methoxy-N-[(6-methoxy-3-pyridinyl)methyl]propanamide
CID 106112443
N-[(6-methoxy-3-pyridinyl)methyl]-2-oxo-1H-quinoline-3-carboxamide
CID 16613259

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[(6-methoxy-3-pyridinyl)methyl]benzamide?
The IUPAC name of 2-amino-N-[(6-methoxy-3-pyridinyl)methyl]benzamide (CID 61250537) is 2-amino-N-[(6-methoxy-3-pyridinyl)methyl]benzamide.
What is the SMILES notation for 2-amino-N-[(6-methoxy-3-pyridinyl)methyl]benzamide?
The canonical SMILES for 2-amino-N-[(6-methoxy-3-pyridinyl)methyl]benzamide is COc1ccc(CNC(=O)c2ccccc2N)cn1.
What is the InChIKey of 2-amino-N-[(6-methoxy-3-pyridinyl)methyl]benzamide?
The InChIKey is VLLPZVUWWMXIGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O2/c1-19-13-7-6-10(8-16-13)9-17-14(18)11-4-2-3-5-12(11)15/h2-8H,9,15H2,1H3,(H,17,18).
What are the key properties of 2-amino-N-[(6-methoxy-3-pyridinyl)methyl]benzamide?
2-amino-N-[(6-methoxy-3-pyridinyl)methyl]benzamide has a molecular weight of 257.29 g/mol, XLogP of 1.60, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[(6-methoxy-3-pyridinyl)methyl]benzamide is sourced from PubChem (CID 61250537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).