5-[butyl(methyl)amino]-N-(2,4,6-trimethylphenyl)pyridine-3-carboxamide

C20H27N3O — CID 109240384

IUPAC5-[butyl(methyl)amino]-N-(2,4,6-trimethylphenyl)pyridine-3-carboxamide
SMILESCCCCN(C)c1cncc(C(=O)Nc2c(C)cc(C)cc2C)c1
InChIInChI=1S/C20H27N3O/c1-6-7-8-23(5)18-11-17(12-21-13-18)20(24)22-19-15(3)9-14(2)10-16(19)4/h9-13H,6-8H2,1-5H3,(H,22,24)
InChIKeyLYRZXXNQIBQNOY-UHFFFAOYSA-N
MW325.46 g/mol
LogP4.50
Rot. Bonds6

About 5-[butyl(methyl)amino]-N-(2,4,6-trimethylphenyl)pyridine-3-carboxamide

5-[butyl(methyl)amino]-N-(2,4,6-trimethylphenyl)pyridine-3-carboxamide (PubChem CID 109240384) has the molecular formula C20H27N3O and a molecular weight of 325.46 g/mol. Its IUPAC name is 5-[butyl(methyl)amino]-N-(2,4,6-trimethylphenyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name5-[butyl(methyl)amino]-N-(2,4,6-trimethylphenyl)pyridine-3-carboxamide
PubChem CID109240384
Molecular FormulaC20H27N3O
Molecular Weight325.46 g/mol
Exact Mass325.22
IUPAC Name5-[butyl(methyl)amino]-N-(2,4,6-trimethylphenyl)pyridine-3-carboxamide
SMILESCCCCN(C)c1cncc(C(=O)Nc2c(C)cc(C)cc2C)c1
InChIInChI=1S/C20H27N3O/c1-6-7-8-23(5)18-11-17(12-21-13-18)20(24)22-19-15(3)9-14(2)10-16(19)4/h9-13H,6-8H2,1-5H3,(H,22,24)
InChIKeyLYRZXXNQIBQNOY-UHFFFAOYSA-N
XLogP4.50
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.46
LogP ≤ 54.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[butyl(methyl)amino]-N-(2,4,6-trimethylphenyl)pyrimidine-5-carboxamide
CID 109264005
5-[butyl(methyl)amino]-N-(3-methylphenyl)pyridine-3-carboxamide
CID 109240367
5-[butyl(methyl)amino]-N-phenylpyridine-3-carboxamide
CID 109240365
4-[butyl(methyl)amino]-N-(2,4,6-trimethylphenyl)pyridine-2-carboxamide
CID 109217835
3-N-propyl-5-N-(2,4,6-trimethylphenyl)pyridine-3,5-dicarboxamide
CID 109101238
5-[butyl(methyl)amino]-N-(2-fluorophenyl)pyridine-3-carboxamide
CID 109240389
5-[butyl(methyl)amino]-N-cyclopropylpyridine-3-carboxamide
CID 109223633
5-(propylamino)-N-(2,4,6-trimethylphenyl)pyridine-3-carboxamide
CID 109223068
5-[butyl(methyl)amino]-N,N-diethylpyridine-3-carboxamide
CID 109238765
N-benzyl-5-[butyl(methyl)amino]pyridine-3-carboxamide
CID 109231681
5-[butyl(methyl)amino]-N-[4-chloro-2-(trifluoromethyl)phenyl]pyridine-3-carboxamide
CID 109240451
5-[butyl(methyl)amino]-N-(2-morpholin-4-ylethyl)pyridine-3-carboxamide
CID 109229497

Frequently Asked Questions

What is the IUPAC name of 5-[butyl(methyl)amino]-N-(2,4,6-trimethylphenyl)pyridine-3-carboxamide?
The IUPAC name of 5-[butyl(methyl)amino]-N-(2,4,6-trimethylphenyl)pyridine-3-carboxamide (CID 109240384) is 5-[butyl(methyl)amino]-N-(2,4,6-trimethylphenyl)pyridine-3-carboxamide.
What is the SMILES notation for 5-[butyl(methyl)amino]-N-(2,4,6-trimethylphenyl)pyridine-3-carboxamide?
The canonical SMILES for 5-[butyl(methyl)amino]-N-(2,4,6-trimethylphenyl)pyridine-3-carboxamide is CCCCN(C)c1cncc(C(=O)Nc2c(C)cc(C)cc2C)c1.
What is the InChIKey of 5-[butyl(methyl)amino]-N-(2,4,6-trimethylphenyl)pyridine-3-carboxamide?
The InChIKey is LYRZXXNQIBQNOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H27N3O/c1-6-7-8-23(5)18-11-17(12-21-13-18)20(24)22-19-15(3)9-14(2)10-16(19)4/h9-13H,6-8H2,1-5H3,(H,22,24).
What are the key properties of 5-[butyl(methyl)amino]-N-(2,4,6-trimethylphenyl)pyridine-3-carboxamide?
5-[butyl(methyl)amino]-N-(2,4,6-trimethylphenyl)pyridine-3-carboxamide has a molecular weight of 325.46 g/mol, XLogP of 4.50, 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-(2,4,6-trimethylphenyl)pyridine-3-carboxamide is sourced from PubChem (CID 109240384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).