3-amino-N-(2-hydroxy-2-methylbutyl)pyridine-2-carboxamide

C11H17N3O2 — CID 104742439

IUPAC3-amino-N-(2-hydroxy-2-methylbutyl)pyridine-2-carboxamide
SMILESCCC(C)(O)CNC(=O)c1ncccc1N
InChIInChI=1S/C11H17N3O2/c1-3-11(2,16)7-14-10(15)9-8(12)5-4-6-13-9/h4-6,16H,3,7,12H2,1-2H3,(H,14,15)
InChIKeyUDNYZHNSWPPTSR-UHFFFAOYSA-N
MW223.28 g/mol
LogP0.55
Rot. Bonds4

About 3-amino-N-(2-hydroxy-2-methylbutyl)pyridine-2-carboxamide

3-amino-N-(2-hydroxy-2-methylbutyl)pyridine-2-carboxamide (PubChem CID 104742439) has the molecular formula C11H17N3O2 and a molecular weight of 223.28 g/mol. Its IUPAC name is 3-amino-N-(2-hydroxy-2-methylbutyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name3-amino-N-(2-hydroxy-2-methylbutyl)pyridine-2-carboxamide
PubChem CID104742439
Molecular FormulaC11H17N3O2
Molecular Weight223.28 g/mol
Exact Mass223.13
IUPAC Name3-amino-N-(2-hydroxy-2-methylbutyl)pyridine-2-carboxamide
SMILESCCC(C)(O)CNC(=O)c1ncccc1N
InChIInChI=1S/C11H17N3O2/c1-3-11(2,16)7-14-10(15)9-8(12)5-4-6-13-9/h4-6,16H,3,7,12H2,1-2H3,(H,14,15)
InChIKeyUDNYZHNSWPPTSR-UHFFFAOYSA-N
XLogP0.55
TPSA88.24 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.28
LogP ≤ 50.55
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 3-amino-N-(2-hydroxy-2-methylbutyl)pyridine-2-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

1-[(3-amino-2-pyridinyl)amino]-2-methylbutan-2-ol
CID 65103157
3-amino-N-(2-methyl-2-thiophen-2-ylpropyl)pyridine-2-carboxamide
CID 104742615
3-hydroxy-N-(2-hydroxy-2-methylpentyl)pyridine-2-carboxamide
CID 103725204
2-amino-N-(2-hydroxy-2-methylbutyl)-6-methoxybenzamide
CID 81420537
3-amino-N-(2-methoxyethyl)pyridine-2-carboxamide
CID 104740778
3-amino-N-(2-methylprop-2-enyl)pyridine-2-carboxamide
CID 114617075
N-(2,2-dimethylbutyl)-3-hydroxypyridine-2-carboxamide
CID 103461999
3-amino-N-(4-amino-2-methyl-4-oxobutan-2-yl)pyridine-2-carboxamide
CID 106096469
3-amino-N-[2-(diethylamino)ethyl]pyridine-2-carboxamide
CID 104740794
3-amino-N-[(3-ethyl-2-pyridinyl)methyl]pyridine-2-carboxamide
CID 104742770
ethyl 4-[(3-aminopyridine-2-carbonyl)amino]butanoate
CID 104742417
3-[[(3-amino-2-pyridinyl)amino]methyl]pentan-3-ol
CID 65102956

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(2-hydroxy-2-methylbutyl)pyridine-2-carboxamide?
The IUPAC name of 3-amino-N-(2-hydroxy-2-methylbutyl)pyridine-2-carboxamide (CID 104742439) is 3-amino-N-(2-hydroxy-2-methylbutyl)pyridine-2-carboxamide.
What is the SMILES notation for 3-amino-N-(2-hydroxy-2-methylbutyl)pyridine-2-carboxamide?
The canonical SMILES for 3-amino-N-(2-hydroxy-2-methylbutyl)pyridine-2-carboxamide is CCC(C)(O)CNC(=O)c1ncccc1N.
What is the InChIKey of 3-amino-N-(2-hydroxy-2-methylbutyl)pyridine-2-carboxamide?
The InChIKey is UDNYZHNSWPPTSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O2/c1-3-11(2,16)7-14-10(15)9-8(12)5-4-6-13-9/h4-6,16H,3,7,12H2,1-2H3,(H,14,15).
What are the key properties of 3-amino-N-(2-hydroxy-2-methylbutyl)pyridine-2-carboxamide?
3-amino-N-(2-hydroxy-2-methylbutyl)pyridine-2-carboxamide has a molecular weight of 223.28 g/mol, XLogP of 0.55, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(2-hydroxy-2-methylbutyl)pyridine-2-carboxamide is sourced from PubChem (CID 104742439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).