5-[butyl(methyl)amino]-N-(3-methylphenyl)pyridine-3-carboxamide

C18H23N3O — CID 109240367

IUPAC5-[butyl(methyl)amino]-N-(3-methylphenyl)pyridine-3-carboxamide
SMILESCCCCN(C)c1cncc(C(=O)Nc2cccc(C)c2)c1
InChIInChI=1S/C18H23N3O/c1-4-5-9-21(3)17-11-15(12-19-13-17)18(22)20-16-8-6-7-14(2)10-16/h6-8,10-13H,4-5,9H2,1-3H3,(H,20,22)
InChIKeyYVHFROGLBDVIMH-UHFFFAOYSA-N
MW297.40 g/mol
LogP3.88
Rot. Bonds6

About 5-[butyl(methyl)amino]-N-(3-methylphenyl)pyridine-3-carboxamide

5-[butyl(methyl)amino]-N-(3-methylphenyl)pyridine-3-carboxamide (PubChem CID 109240367) has the molecular formula C18H23N3O and a molecular weight of 297.40 g/mol. Its IUPAC name is 5-[butyl(methyl)amino]-N-(3-methylphenyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name5-[butyl(methyl)amino]-N-(3-methylphenyl)pyridine-3-carboxamide
PubChem CID109240367
Molecular FormulaC18H23N3O
Molecular Weight297.40 g/mol
Exact Mass297.18
IUPAC Name5-[butyl(methyl)amino]-N-(3-methylphenyl)pyridine-3-carboxamide
SMILESCCCCN(C)c1cncc(C(=O)Nc2cccc(C)c2)c1
InChIInChI=1S/C18H23N3O/c1-4-5-9-21(3)17-11-15(12-19-13-17)18(22)20-16-8-6-7-14(2)10-16/h6-8,10-13H,4-5,9H2,1-3H3,(H,20,22)
InChIKeyYVHFROGLBDVIMH-UHFFFAOYSA-N
XLogP3.88
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.40
LogP ≤ 53.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 5-[butyl(methyl)amino]-N-(3-methylphenyl)pyridine-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

5-[butyl(methyl)amino]-N-phenylpyridine-3-carboxamide
CID 109240365
5-(diethylamino)-N-(3-methylphenyl)pyridine-3-carboxamide
CID 109238900
5-[butyl(methyl)amino]-N-(2,4,6-trimethylphenyl)pyridine-3-carboxamide
CID 109240384
3-N-(3-methylphenyl)-5-N,5-N-dipropylpyridine-3,5-dicarboxamide
CID 109107576
5-[butyl(methyl)amino]-N-(2-fluorophenyl)pyridine-3-carboxamide
CID 109240389
5-hydroxy-N-(3-methylphenyl)pyridine-3-carboxamide
CID 63865627
N-benzyl-5-[butyl(methyl)amino]pyridine-3-carboxamide
CID 109231681
N-(3-acetylphenyl)-5-[methyl(2-pyridin-4-ylethyl)amino]pyridine-3-carboxamide
CID 109237130
5-[butyl(methyl)amino]-N-(3,5-dimethylphenyl)pyridine-2-carboxamide
CID 109196048
N-(3-bromophenyl)-5-[butyl(methyl)amino]pyridine-2-carboxamide
CID 109196108
1-butyl-1-methyl-3-(3-methylphenyl)urea
CID 5220454
5-[butyl(methyl)amino]-N-cyclopropylpyridine-3-carboxamide
CID 109223633

Frequently Asked Questions

What is the IUPAC name of 5-[butyl(methyl)amino]-N-(3-methylphenyl)pyridine-3-carboxamide?
The IUPAC name of 5-[butyl(methyl)amino]-N-(3-methylphenyl)pyridine-3-carboxamide (CID 109240367) is 5-[butyl(methyl)amino]-N-(3-methylphenyl)pyridine-3-carboxamide.
What is the SMILES notation for 5-[butyl(methyl)amino]-N-(3-methylphenyl)pyridine-3-carboxamide?
The canonical SMILES for 5-[butyl(methyl)amino]-N-(3-methylphenyl)pyridine-3-carboxamide is CCCCN(C)c1cncc(C(=O)Nc2cccc(C)c2)c1.
What is the InChIKey of 5-[butyl(methyl)amino]-N-(3-methylphenyl)pyridine-3-carboxamide?
The InChIKey is YVHFROGLBDVIMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N3O/c1-4-5-9-21(3)17-11-15(12-19-13-17)18(22)20-16-8-6-7-14(2)10-16/h6-8,10-13H,4-5,9H2,1-3H3,(H,20,22).
What are the key properties of 5-[butyl(methyl)amino]-N-(3-methylphenyl)pyridine-3-carboxamide?
5-[butyl(methyl)amino]-N-(3-methylphenyl)pyridine-3-carboxamide has a molecular weight of 297.40 g/mol, XLogP of 3.88, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[butyl(methyl)amino]-N-(3-methylphenyl)pyridine-3-carboxamide is sourced from PubChem (CID 109240367), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).