N-butan-2-yl-5-(3-methylbutylamino)pyridine-3-carboxamide

C15H25N3O — CID 109225189

IUPACN-butan-2-yl-5-(3-methylbutylamino)pyridine-3-carboxamide
SMILESCCC(C)NC(=O)c1cncc(NCCC(C)C)c1
InChIInChI=1S/C15H25N3O/c1-5-12(4)18-15(19)13-8-14(10-16-9-13)17-7-6-11(2)3/h8-12,17H,5-7H2,1-4H3,(H,18,19)
InChIKeyZTZYZKGCCJOHFJ-UHFFFAOYSA-N
MW263.38 g/mol
LogP3.07
Rot. Bonds7

About N-butan-2-yl-5-(3-methylbutylamino)pyridine-3-carboxamide

N-butan-2-yl-5-(3-methylbutylamino)pyridine-3-carboxamide (PubChem CID 109225189) has the molecular formula C15H25N3O and a molecular weight of 263.38 g/mol. Its IUPAC name is N-butan-2-yl-5-(3-methylbutylamino)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-butan-2-yl-5-(3-methylbutylamino)pyridine-3-carboxamide
PubChem CID109225189
Molecular FormulaC15H25N3O
Molecular Weight263.38 g/mol
Exact Mass263.20
IUPAC NameN-butan-2-yl-5-(3-methylbutylamino)pyridine-3-carboxamide
SMILESCCC(C)NC(=O)c1cncc(NCCC(C)C)c1
InChIInChI=1S/C15H25N3O/c1-5-12(4)18-15(19)13-8-14(10-16-9-13)17-7-6-11(2)3/h8-12,17H,5-7H2,1-4H3,(H,18,19)
InChIKeyZTZYZKGCCJOHFJ-UHFFFAOYSA-N
XLogP3.07
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 53.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-butan-2-yl-5-(3-methoxypropylamino)pyridine-3-carboxamide
CID 109225122
N-butan-2-yl-5-(tert-butylamino)pyridine-3-carboxamide
CID 109225186
N-butan-2-yl-5-fluoropyridine-3-carboxamide
CID 115694418
N-butan-2-yl-5-[2-(cyclohexen-1-yl)ethylamino]pyridine-3-carboxamide
CID 109225120
5-(3-methylbutylamino)-N-(2,4,6-trimethylphenyl)pyridine-3-carboxamide
CID 109239926
N-(4-tert-butylphenyl)-5-(3-methylbutylamino)pyridine-3-carboxamide
CID 109239930
N-butan-2-yl-5-[(2-methylphenyl)methylamino]pyridine-3-carboxamide
CID 109225134
N-butan-2-yl-5-(3,5-dichloroanilino)pyridine-3-carboxamide
CID 109225291
N-butan-2-yl-5-(2,4,6-trimethylanilino)pyridine-3-carboxamide
CID 109225219
N-[4-(dimethylamino)phenyl]-5-(3-methylbutylamino)pyridine-3-carboxamide
CID 109239969
N-butan-2-yl-5-(3-chloro-4-methylanilino)pyridine-3-carboxamide
CID 109225232
5-bromo-N-(5-methylhexan-2-yl)pyridine-3-carboxamide
CID 60628143

Frequently Asked Questions

What is the IUPAC name of N-butan-2-yl-5-(3-methylbutylamino)pyridine-3-carboxamide?
The IUPAC name of N-butan-2-yl-5-(3-methylbutylamino)pyridine-3-carboxamide (CID 109225189) is N-butan-2-yl-5-(3-methylbutylamino)pyridine-3-carboxamide.
What is the SMILES notation for N-butan-2-yl-5-(3-methylbutylamino)pyridine-3-carboxamide?
The canonical SMILES for N-butan-2-yl-5-(3-methylbutylamino)pyridine-3-carboxamide is CCC(C)NC(=O)c1cncc(NCCC(C)C)c1.
What is the InChIKey of N-butan-2-yl-5-(3-methylbutylamino)pyridine-3-carboxamide?
The InChIKey is ZTZYZKGCCJOHFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O/c1-5-12(4)18-15(19)13-8-14(10-16-9-13)17-7-6-11(2)3/h8-12,17H,5-7H2,1-4H3,(H,18,19).
What are the key properties of N-butan-2-yl-5-(3-methylbutylamino)pyridine-3-carboxamide?
N-butan-2-yl-5-(3-methylbutylamino)pyridine-3-carboxamide has a molecular weight of 263.38 g/mol, XLogP of 3.07, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-butan-2-yl-5-(3-methylbutylamino)pyridine-3-carboxamide is sourced from PubChem (CID 109225189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).