6-amino-N-(4-methoxybutyl)pyridine-2-carboxamide

C11H17N3O2 — CID 62238827

IUPAC6-amino-N-(4-methoxybutyl)pyridine-2-carboxamide
SMILESCOCCCCNC(=O)c1cccc(N)n1
InChIInChI=1S/C11H17N3O2/c1-16-8-3-2-7-13-11(15)9-5-4-6-10(12)14-9/h4-6H,2-3,7-8H2,1H3,(H2,12,14)(H,13,15)
InChIKeyVRGUYRHOIQPBDH-UHFFFAOYSA-N
MW223.28 g/mol
LogP0.82
Rot. Bonds6

About 6-amino-N-(4-methoxybutyl)pyridine-2-carboxamide

6-amino-N-(4-methoxybutyl)pyridine-2-carboxamide (PubChem CID 62238827) has the molecular formula C11H17N3O2 and a molecular weight of 223.28 g/mol. Its IUPAC name is 6-amino-N-(4-methoxybutyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name6-amino-N-(4-methoxybutyl)pyridine-2-carboxamide
PubChem CID62238827
Molecular FormulaC11H17N3O2
Molecular Weight223.28 g/mol
Exact Mass223.13
IUPAC Name6-amino-N-(4-methoxybutyl)pyridine-2-carboxamide
SMILESCOCCCCNC(=O)c1cccc(N)n1
InChIInChI=1S/C11H17N3O2/c1-16-8-3-2-7-13-11(15)9-5-4-6-10(12)14-9/h4-6H,2-3,7-8H2,1H3,(H2,12,14)(H,13,15)
InChIKeyVRGUYRHOIQPBDH-UHFFFAOYSA-N
XLogP0.82
TPSA77.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.28
LogP ≤ 50.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

6-amino-N-(5-methylsulfanylpentyl)pyridine-2-carboxamide
CID 114129261
6-amino-N-[3-(diethylamino)propyl]pyridine-2-carboxamide
CID 62238759
6-methoxy-N-(3-methoxypropyl)pyridine-2-carboxamide
CID 84581499
6-amino-N-(5-methoxypentyl)pyridazine-3-carboxamide
CID 114131484
6-amino-N-(2-methylsulfonylethyl)pyridine-2-carboxamide
CID 62240593
6-amino-N-[2-[ethyl(methyl)amino]ethyl]pyridine-2-carboxamide
CID 62641667
6-amino-N-[2-(methylsulfamoyl)ethyl]pyridine-2-carboxamide
CID 106342484
6-N-cyclopentyl-2-N-(3-methoxypropyl)pyridine-2,6-dicarboxamide
CID 109094939
6-N-[2-(4-methoxyphenyl)ethyl]-2-N-(3-methoxypropyl)pyridine-2,6-dicarboxamide
CID 109095851
6-amino-N-[2-(3,4-dimethoxyphenyl)ethyl]pyridine-2-carboxamide;hydrochloride
CID 119998901
2-N,6-N-didecylpyridine-2,6-dicarboxamide
CID 4564479
3-amino-N-(4-methoxybutyl)pyridine-2-carboxamide
CID 104742127

Frequently Asked Questions

What is the IUPAC name of 6-amino-N-(4-methoxybutyl)pyridine-2-carboxamide?
The IUPAC name of 6-amino-N-(4-methoxybutyl)pyridine-2-carboxamide (CID 62238827) is 6-amino-N-(4-methoxybutyl)pyridine-2-carboxamide.
What is the SMILES notation for 6-amino-N-(4-methoxybutyl)pyridine-2-carboxamide?
The canonical SMILES for 6-amino-N-(4-methoxybutyl)pyridine-2-carboxamide is COCCCCNC(=O)c1cccc(N)n1.
What is the InChIKey of 6-amino-N-(4-methoxybutyl)pyridine-2-carboxamide?
The InChIKey is VRGUYRHOIQPBDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O2/c1-16-8-3-2-7-13-11(15)9-5-4-6-10(12)14-9/h4-6H,2-3,7-8H2,1H3,(H2,12,14)(H,13,15).
What are the key properties of 6-amino-N-(4-methoxybutyl)pyridine-2-carboxamide?
6-amino-N-(4-methoxybutyl)pyridine-2-carboxamide has a molecular weight of 223.28 g/mol, XLogP of 0.82, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-N-(4-methoxybutyl)pyridine-2-carboxamide is sourced from PubChem (CID 62238827), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).