N-(2-hydroxy-2,3-dimethylbutyl)-2-(propan-2-ylamino)pyridine-3-carboxamide

C15H25N3O2 — CID 111483935

IUPACN-(2-hydroxy-2,3-dimethylbutyl)-2-(propan-2-ylamino)pyridine-3-carboxamide
SMILESCC(C)Nc1ncccc1C(=O)NCC(C)(O)C(C)C
InChIInChI=1S/C15H25N3O2/c1-10(2)15(5,20)9-17-14(19)12-7-6-8-16-13(12)18-11(3)4/h6-8,10-11,20H,9H2,1-5H3,(H,16,18)(H,17,19)
InChIKeyKSAOMHCTQLCZDT-UHFFFAOYSA-N
MW279.38 g/mol
LogP2.04
Rot. Bonds6

About N-(2-hydroxy-2,3-dimethylbutyl)-2-(propan-2-ylamino)pyridine-3-carboxamide

N-(2-hydroxy-2,3-dimethylbutyl)-2-(propan-2-ylamino)pyridine-3-carboxamide (PubChem CID 111483935) has the molecular formula C15H25N3O2 and a molecular weight of 279.38 g/mol. Its IUPAC name is N-(2-hydroxy-2,3-dimethylbutyl)-2-(propan-2-ylamino)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2-hydroxy-2,3-dimethylbutyl)-2-(propan-2-ylamino)pyridine-3-carboxamide
PubChem CID111483935
Molecular FormulaC15H25N3O2
Molecular Weight279.38 g/mol
Exact Mass279.19
IUPAC NameN-(2-hydroxy-2,3-dimethylbutyl)-2-(propan-2-ylamino)pyridine-3-carboxamide
SMILESCC(C)Nc1ncccc1C(=O)NCC(C)(O)C(C)C
InChIInChI=1S/C15H25N3O2/c1-10(2)15(5,20)9-17-14(19)12-7-6-8-16-13(12)18-11(3)4/h6-8,10-11,20H,9H2,1-5H3,(H,16,18)(H,17,19)
InChIKeyKSAOMHCTQLCZDT-UHFFFAOYSA-N
XLogP2.04
TPSA74.25 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.38
LogP ≤ 52.04
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze N-(2-hydroxy-2,3-dimethylbutyl)-2-(propan-2-ylamino)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

2-chloro-N-[(2R,3R)-2-hydroxy-2,3-dimethylpentyl]pyridine-3-carboxamide
CID 95987001
N-(2,2-dimethylpropyl)-2-(methylamino)pyridine-3-carboxamide
CID 62181506
N-(2-amino-2-phenylethyl)-2-(propan-2-ylamino)pyridine-3-carboxamide
CID 119527886
N-[(2-hydroxycyclopentyl)methyl]-2-(propan-2-ylamino)pyridine-3-carboxamide
CID 111540624
N-(3-hydroxy-3-phenylpropyl)-2-(propan-2-ylamino)pyridine-3-carboxamide
CID 111661954
N-[2-(3-chlorophenyl)ethyl]-2-(propan-2-ylamino)pyridine-3-carboxamide
CID 129316266
N-(2-hydroxy-2,3-dimethylbutyl)benzamide
CID 111484208
N-(2,2-dimethylpropyl)-2-hydrazinylpyridine-3-carboxamide
CID 62237892
N-cyclohexyl-2-(propan-2-ylamino)pyridine-3-carboxamide
CID 44761338
N-(4-hydroxyphenyl)-2-(propan-2-ylamino)pyridine-3-carboxamide
CID 84574934
N-(2-hydroxy-2,3-dimethylbutyl)-5-methyl-1-pyridin-2-ylpyrazole-4-carboxamide
CID 111484404
N-(2-hydroxy-2-methylpropyl)quinoline-8-carboxamide
CID 65109650

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxy-2,3-dimethylbutyl)-2-(propan-2-ylamino)pyridine-3-carboxamide?
The IUPAC name of N-(2-hydroxy-2,3-dimethylbutyl)-2-(propan-2-ylamino)pyridine-3-carboxamide (CID 111483935) is N-(2-hydroxy-2,3-dimethylbutyl)-2-(propan-2-ylamino)pyridine-3-carboxamide.
What is the SMILES notation for N-(2-hydroxy-2,3-dimethylbutyl)-2-(propan-2-ylamino)pyridine-3-carboxamide?
The canonical SMILES for N-(2-hydroxy-2,3-dimethylbutyl)-2-(propan-2-ylamino)pyridine-3-carboxamide is CC(C)Nc1ncccc1C(=O)NCC(C)(O)C(C)C.
What is the InChIKey of N-(2-hydroxy-2,3-dimethylbutyl)-2-(propan-2-ylamino)pyridine-3-carboxamide?
The InChIKey is KSAOMHCTQLCZDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O2/c1-10(2)15(5,20)9-17-14(19)12-7-6-8-16-13(12)18-11(3)4/h6-8,10-11,20H,9H2,1-5H3,(H,16,18)(H,17,19).
What are the key properties of N-(2-hydroxy-2,3-dimethylbutyl)-2-(propan-2-ylamino)pyridine-3-carboxamide?
N-(2-hydroxy-2,3-dimethylbutyl)-2-(propan-2-ylamino)pyridine-3-carboxamide has a molecular weight of 279.38 g/mol, XLogP of 2.04, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxy-2,3-dimethylbutyl)-2-(propan-2-ylamino)pyridine-3-carboxamide is sourced from PubChem (CID 111483935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).