N-(4-methylpentyl)-6-propan-2-ylpyridine-3-carboxamide

C15H24N2O — CID 158554805

IUPACN-(4-methylpentyl)-6-propan-2-ylpyridine-3-carboxamide
SMILESCC(C)CCCNC(=O)c1ccc(C(C)C)nc1
InChIInChI=1S/C15H24N2O/c1-11(2)6-5-9-16-15(18)13-7-8-14(12(3)4)17-10-13/h7-8,10-12H,5-6,9H2,1-4H3,(H,16,18)
InChIKeyFREAEZNAFKXKOV-UHFFFAOYSA-N
MW248.37 g/mol
LogP3.37
Rot. Bonds6

About N-(4-methylpentyl)-6-propan-2-ylpyridine-3-carboxamide

N-(4-methylpentyl)-6-propan-2-ylpyridine-3-carboxamide (PubChem CID 158554805) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is N-(4-methylpentyl)-6-propan-2-ylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-(4-methylpentyl)-6-propan-2-ylpyridine-3-carboxamide
PubChem CID158554805
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC NameN-(4-methylpentyl)-6-propan-2-ylpyridine-3-carboxamide
SMILESCC(C)CCCNC(=O)c1ccc(C(C)C)nc1
InChIInChI=1S/C15H24N2O/c1-11(2)6-5-9-16-15(18)13-7-8-14(12(3)4)17-10-13/h7-8,10-12H,5-6,9H2,1-4H3,(H,16,18)
InChIKeyFREAEZNAFKXKOV-UHFFFAOYSA-N
XLogP3.37
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 53.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

6-chloro-N-(5-methylhexyl)pyridine-3-carboxamide
CID 79003057
N-[3-(4,5-dihydroimidazol-1-yl)propyl]-6-propan-2-ylpyridine-3-carboxamide
CID 91606822
4-[hydroxy(dimethyl)silyl]-N-(4-methylpentyl)benzamide
CID 157299766
4-[[4-(4-methylpentylcarbamoyl)benzoyl]amino]butylazanide;rubidium(1+)
CID 171640058
N-[(2R)-1-(dimethylamino)propan-2-yl]-6-propan-2-ylpyridine-3-carboxamide
CID 59987604
2-fluoro-N-(4-methylpentyl)pyridine-4-carboxamide
CID 61293855
6-methyl-N-[3-[(6-methylpyridine-3-carbonyl)amino]propyl]pyridine-3-carboxamide
CID 3159007
5-chloro-6-hydrazinyl-N-(5-methylhexyl)pyridine-3-carboxamide
CID 113287874
4-amino-N-(6-methylheptyl)benzamide
CID 22753103
N-decyl-6-[5-(decylcarbamoyl)-2-pyridinyl]pyridine-3-carboxamide
CID 102199580
5-carbamothioyl-N-(7-methyloctyl)pyridine-2-carboxamide
CID 107815227
4-amino-3-methoxy-N-(4-methylpentyl)benzamide
CID 104782675

Frequently Asked Questions

What is the IUPAC name of N-(4-methylpentyl)-6-propan-2-ylpyridine-3-carboxamide?
The IUPAC name of N-(4-methylpentyl)-6-propan-2-ylpyridine-3-carboxamide (CID 158554805) is N-(4-methylpentyl)-6-propan-2-ylpyridine-3-carboxamide.
What is the SMILES notation for N-(4-methylpentyl)-6-propan-2-ylpyridine-3-carboxamide?
The canonical SMILES for N-(4-methylpentyl)-6-propan-2-ylpyridine-3-carboxamide is CC(C)CCCNC(=O)c1ccc(C(C)C)nc1.
What is the InChIKey of N-(4-methylpentyl)-6-propan-2-ylpyridine-3-carboxamide?
The InChIKey is FREAEZNAFKXKOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-11(2)6-5-9-16-15(18)13-7-8-14(12(3)4)17-10-13/h7-8,10-12H,5-6,9H2,1-4H3,(H,16,18).
What are the key properties of N-(4-methylpentyl)-6-propan-2-ylpyridine-3-carboxamide?
N-(4-methylpentyl)-6-propan-2-ylpyridine-3-carboxamide has a molecular weight of 248.37 g/mol, XLogP of 3.37, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methylpentyl)-6-propan-2-ylpyridine-3-carboxamide is sourced from PubChem (CID 158554805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).