1-methyl-N-[4-(methylamino)butyl]-2-oxo-6-propan-2-ylpyridine-3-carboxamide

C15H25N3O2 — CID 74250998

IUPAC1-methyl-N-[4-(methylamino)butyl]-2-oxo-6-propan-2-ylpyridine-3-carboxamide
SMILESCNCCCCNC(=O)c1ccc(C(C)C)n(C)c1=O
InChIInChI=1S/C15H25N3O2/c1-11(2)13-8-7-12(15(20)18(13)4)14(19)17-10-6-5-9-16-3/h7-8,11,16H,5-6,9-10H2,1-4H3,(H,17,19)
InChIKeyLYRQIWOGMANDNQ-UHFFFAOYSA-N
MW279.38 g/mol
LogP1.24
Rot. Bonds7

About 1-methyl-N-[4-(methylamino)butyl]-2-oxo-6-propan-2-ylpyridine-3-carboxamide

1-methyl-N-[4-(methylamino)butyl]-2-oxo-6-propan-2-ylpyridine-3-carboxamide (PubChem CID 74250998) has the molecular formula C15H25N3O2 and a molecular weight of 279.38 g/mol. Its IUPAC name is 1-methyl-N-[4-(methylamino)butyl]-2-oxo-6-propan-2-ylpyridine-3-carboxamide.

Molecular Properties

Compound Name1-methyl-N-[4-(methylamino)butyl]-2-oxo-6-propan-2-ylpyridine-3-carboxamide
PubChem CID74250998
Molecular FormulaC15H25N3O2
Molecular Weight279.38 g/mol
Exact Mass279.19
IUPAC Name1-methyl-N-[4-(methylamino)butyl]-2-oxo-6-propan-2-ylpyridine-3-carboxamide
SMILESCNCCCCNC(=O)c1ccc(C(C)C)n(C)c1=O
InChIInChI=1S/C15H25N3O2/c1-11(2)13-8-7-12(15(20)18(13)4)14(19)17-10-6-5-9-16-3/h7-8,11,16H,5-6,9-10H2,1-4H3,(H,17,19)
InChIKeyLYRQIWOGMANDNQ-UHFFFAOYSA-N
XLogP1.24
TPSA63.13 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.38
LogP ≤ 51.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 1-methyl-N-[4-(methylamino)butyl]-2-oxo-6-propan-2-ylpyridine-3-carboxamide 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

1,6-dimethyl-N-[4-(methylamino)butyl]-2-oxopyridine-3-carboxamide
CID 74237704
N-[2-(hydroxymethyl)-3-thiophen-2-ylpropyl]-1-methyl-2-oxo-6-propan-2-ylpyridine-3-carboxamide
CID 77083262
1,3-dimethyl-2,4-dioxo-N-(4-pyrrolidin-1-ylbutyl)pyrimidine-5-carboxamide
CID 84555556
N-[3-(4-methylpiperazin-1-yl)propyl]-2-oxo-6-propan-2-yl-1H-pyridine-3-carboxamide
CID 74234352
8-[(1-methyl-2-oxopyridine-3-carbonyl)amino]octanoic acid
CID 120535591
2-hydroxy-N-pentyl-3-propan-2-ylbenzamide
CID 70943726
1,3-dimethyl-N-(3-methylbutyl)-2,4-dioxopyrimidine-5-carboxamide
CID 84557715
2-methyl-N-[3-(methylamino)propyl]-6-phenylpyridine-3-carboxamide
CID 119431609
N-(3-butoxypropyl)-1,3-dimethyl-2,4-dioxopyrimidine-5-carboxamide
CID 84555533
4-methoxy-N-[3-(methylamino)propyl]naphthalene-1-carboxamide
CID 119431564
N-[3-(methylamino)propyl]-2-oxo-1H-pyridine-3-carboxamide
CID 43600703
2-acetyl-N-[3-(methylamino)propyl]benzamide;hydrochloride
CID 119429539

Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-[4-(methylamino)butyl]-2-oxo-6-propan-2-ylpyridine-3-carboxamide?
The IUPAC name of 1-methyl-N-[4-(methylamino)butyl]-2-oxo-6-propan-2-ylpyridine-3-carboxamide (CID 74250998) is 1-methyl-N-[4-(methylamino)butyl]-2-oxo-6-propan-2-ylpyridine-3-carboxamide.
What is the SMILES notation for 1-methyl-N-[4-(methylamino)butyl]-2-oxo-6-propan-2-ylpyridine-3-carboxamide?
The canonical SMILES for 1-methyl-N-[4-(methylamino)butyl]-2-oxo-6-propan-2-ylpyridine-3-carboxamide is CNCCCCNC(=O)c1ccc(C(C)C)n(C)c1=O.
What is the InChIKey of 1-methyl-N-[4-(methylamino)butyl]-2-oxo-6-propan-2-ylpyridine-3-carboxamide?
The InChIKey is LYRQIWOGMANDNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O2/c1-11(2)13-8-7-12(15(20)18(13)4)14(19)17-10-6-5-9-16-3/h7-8,11,16H,5-6,9-10H2,1-4H3,(H,17,19).
What are the key properties of 1-methyl-N-[4-(methylamino)butyl]-2-oxo-6-propan-2-ylpyridine-3-carboxamide?
1-methyl-N-[4-(methylamino)butyl]-2-oxo-6-propan-2-ylpyridine-3-carboxamide has a molecular weight of 279.38 g/mol, XLogP of 1.24, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-[4-(methylamino)butyl]-2-oxo-6-propan-2-ylpyridine-3-carboxamide is sourced from PubChem (CID 74250998), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).