6-(2-hydroxypropan-2-yl)pyridine-2-carboxamide

C9H12N2O2 — CID 155437518

IUPAC6-(2-hydroxypropan-2-yl)pyridine-2-carboxamide
SMILESCC(C)(O)c1cccc(C(N)=O)n1
InChIInChI=1S/C9H12N2O2/c1-9(2,13)7-5-3-4-6(11-7)8(10)12/h3-5,13H,1-2H3,(H2,10,12)
InChIKeyUGZCMNFCLMDPLT-UHFFFAOYSA-N
MW180.21 g/mol
LogP0.41
Rot. Bonds2

About 6-(2-hydroxypropan-2-yl)pyridine-2-carboxamide

6-(2-hydroxypropan-2-yl)pyridine-2-carboxamide (PubChem CID 155437518) has the molecular formula C9H12N2O2 and a molecular weight of 180.21 g/mol. Its IUPAC name is 6-(2-hydroxypropan-2-yl)pyridine-2-carboxamide.

Molecular Properties

Compound Name6-(2-hydroxypropan-2-yl)pyridine-2-carboxamide
PubChem CID155437518
Molecular FormulaC9H12N2O2
Molecular Weight180.21 g/mol
Exact Mass180.09
IUPAC Name6-(2-hydroxypropan-2-yl)pyridine-2-carboxamide
SMILESCC(C)(O)c1cccc(C(N)=O)n1
InChIInChI=1S/C9H12N2O2/c1-9(2,13)7-5-3-4-6(11-7)8(10)12/h3-5,13H,1-2H3,(H2,10,12)
InChIKeyUGZCMNFCLMDPLT-UHFFFAOYSA-N
XLogP0.41
TPSA76.21 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.21
LogP ≤ 50.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 6-(2-hydroxypropan-2-yl)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

Frequently Asked Questions

What is the IUPAC name of 6-(2-hydroxypropan-2-yl)pyridine-2-carboxamide?
The IUPAC name of 6-(2-hydroxypropan-2-yl)pyridine-2-carboxamide (CID 155437518) is 6-(2-hydroxypropan-2-yl)pyridine-2-carboxamide.
What is the SMILES notation for 6-(2-hydroxypropan-2-yl)pyridine-2-carboxamide?
The canonical SMILES for 6-(2-hydroxypropan-2-yl)pyridine-2-carboxamide is CC(C)(O)c1cccc(C(N)=O)n1.
What is the InChIKey of 6-(2-hydroxypropan-2-yl)pyridine-2-carboxamide?
The InChIKey is UGZCMNFCLMDPLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N2O2/c1-9(2,13)7-5-3-4-6(11-7)8(10)12/h3-5,13H,1-2H3,(H2,10,12).
What are the key properties of 6-(2-hydroxypropan-2-yl)pyridine-2-carboxamide?
6-(2-hydroxypropan-2-yl)pyridine-2-carboxamide has a molecular weight of 180.21 g/mol, XLogP of 0.41, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-hydroxypropan-2-yl)pyridine-2-carboxamide is sourced from PubChem (CID 155437518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).