N-(2-amino-3-ethylpentyl)-2-methylpyridine-4-carboxamide

C14H23N3O — CID 114168485

IUPACN-(2-amino-3-ethylpentyl)-2-methylpyridine-4-carboxamide
SMILESCCC(CC)C(N)CNC(=O)c1ccnc(C)c1
InChIInChI=1S/C14H23N3O/c1-4-11(5-2)13(15)9-17-14(18)12-6-7-16-10(3)8-12/h6-8,11,13H,4-5,9,15H2,1-3H3,(H,17,18)
InChIKeyHUWGDYAJOYSRSR-UHFFFAOYSA-N
MW249.36 g/mol
LogP1.88
Rot. Bonds6

About N-(2-amino-3-ethylpentyl)-2-methylpyridine-4-carboxamide

N-(2-amino-3-ethylpentyl)-2-methylpyridine-4-carboxamide (PubChem CID 114168485) has the molecular formula C14H23N3O and a molecular weight of 249.36 g/mol. Its IUPAC name is N-(2-amino-3-ethylpentyl)-2-methylpyridine-4-carboxamide.

Molecular Properties

Compound NameN-(2-amino-3-ethylpentyl)-2-methylpyridine-4-carboxamide
PubChem CID114168485
Molecular FormulaC14H23N3O
Molecular Weight249.36 g/mol
Exact Mass249.18
IUPAC NameN-(2-amino-3-ethylpentyl)-2-methylpyridine-4-carboxamide
SMILESCCC(CC)C(N)CNC(=O)c1ccnc(C)c1
InChIInChI=1S/C14H23N3O/c1-4-11(5-2)13(15)9-17-14(18)12-6-7-16-10(3)8-12/h6-8,11,13H,4-5,9,15H2,1-3H3,(H,17,18)
InChIKeyHUWGDYAJOYSRSR-UHFFFAOYSA-N
XLogP1.88
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.36
LogP ≤ 51.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(2R)-2-hydroxybutyl]-2-methylpyridine-4-carboxamide
CID 130260711
N-(2-chlorobutyl)-2-methylpyridine-4-carboxamide
CID 106754279
N-(2-amino-3-ethylpentyl)-3,4-dimethylbenzamide
CID 106285997
N-[(2S)-2-hydroxypropyl]-2-methylpyridine-4-carboxamide
CID 106753450
N-(2-amino-3-ethylpentyl)-3-methylbenzamide
CID 106286438
2-methyl-N-(3-methyl-2-propan-2-ylbutyl)pyridine-4-carboxamide
CID 106753359
2-methyl-3-[(2-methylpyridine-4-carbonyl)amino]propanoic acid
CID 106752586
N-(2-chloro-3-methylbutyl)-2-methylpyridine-4-carboxamide
CID 106754281
N-(2-amino-3-ethylpentyl)-2-oxo-1H-pyridine-4-carboxamide
CID 114168502
N-(4-chloro-2-methylbutyl)-2-methylpyridine-4-carboxamide
CID 106754217
N-(2-amino-3-ethylpentyl)-4-ethylbenzamide
CID 106286266
N-(2-hydroxy-2-methylbutyl)-2-methylpyridine-4-carboxamide
CID 106753404

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-3-ethylpentyl)-2-methylpyridine-4-carboxamide?
The IUPAC name of N-(2-amino-3-ethylpentyl)-2-methylpyridine-4-carboxamide (CID 114168485) is N-(2-amino-3-ethylpentyl)-2-methylpyridine-4-carboxamide.
What is the SMILES notation for N-(2-amino-3-ethylpentyl)-2-methylpyridine-4-carboxamide?
The canonical SMILES for N-(2-amino-3-ethylpentyl)-2-methylpyridine-4-carboxamide is CCC(CC)C(N)CNC(=O)c1ccnc(C)c1.
What is the InChIKey of N-(2-amino-3-ethylpentyl)-2-methylpyridine-4-carboxamide?
The InChIKey is HUWGDYAJOYSRSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O/c1-4-11(5-2)13(15)9-17-14(18)12-6-7-16-10(3)8-12/h6-8,11,13H,4-5,9,15H2,1-3H3,(H,17,18).
What are the key properties of N-(2-amino-3-ethylpentyl)-2-methylpyridine-4-carboxamide?
N-(2-amino-3-ethylpentyl)-2-methylpyridine-4-carboxamide has a molecular weight of 249.36 g/mol, XLogP of 1.88, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-3-ethylpentyl)-2-methylpyridine-4-carboxamide is sourced from PubChem (CID 114168485), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).