[1-(2-pyridin-2-yl-1,3-thiazol-4-yl)cyclopropyl]methanol

C12H12N2OS — CID 116890867

IUPAC[1-(2-pyridin-2-yl-1,3-thiazol-4-yl)cyclopropyl]methanol
SMILESOCC1(c2csc(-c3ccccn3)n2)CC1
InChIInChI=1S/C12H12N2OS/c15-8-12(4-5-12)10-7-16-11(14-10)9-3-1-2-6-13-9/h1-3,6-7,15H,4-5,8H2
InChIKeyNYAXYZSKMKOMCQ-UHFFFAOYSA-N
MW232.31 g/mol
LogP2.23
Rot. Bonds3

About [1-(2-pyridin-2-yl-1,3-thiazol-4-yl)cyclopropyl]methanol

[1-(2-pyridin-2-yl-1,3-thiazol-4-yl)cyclopropyl]methanol (PubChem CID 116890867) has the molecular formula C12H12N2OS and a molecular weight of 232.31 g/mol. Its IUPAC name is [1-(2-pyridin-2-yl-1,3-thiazol-4-yl)cyclopropyl]methanol.

Molecular Properties

Compound Name[1-(2-pyridin-2-yl-1,3-thiazol-4-yl)cyclopropyl]methanol
PubChem CID116890867
Molecular FormulaC12H12N2OS
Molecular Weight232.31 g/mol
Exact Mass232.07
IUPAC Name[1-(2-pyridin-2-yl-1,3-thiazol-4-yl)cyclopropyl]methanol
SMILESOCC1(c2csc(-c3ccccn3)n2)CC1
InChIInChI=1S/C12H12N2OS/c15-8-12(4-5-12)10-7-16-11(14-10)9-3-1-2-6-13-9/h1-3,6-7,15H,4-5,8H2
InChIKeyNYAXYZSKMKOMCQ-UHFFFAOYSA-N
XLogP2.23
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.31
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze [1-(2-pyridin-2-yl-1,3-thiazol-4-yl)cyclopropyl]methanol 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 [1-(2-pyridin-2-yl-1,3-thiazol-4-yl)cyclopropyl]methanol?
The IUPAC name of [1-(2-pyridin-2-yl-1,3-thiazol-4-yl)cyclopropyl]methanol (CID 116890867) is [1-(2-pyridin-2-yl-1,3-thiazol-4-yl)cyclopropyl]methanol.
What is the SMILES notation for [1-(2-pyridin-2-yl-1,3-thiazol-4-yl)cyclopropyl]methanol?
The canonical SMILES for [1-(2-pyridin-2-yl-1,3-thiazol-4-yl)cyclopropyl]methanol is OCC1(c2csc(-c3ccccn3)n2)CC1.
What is the InChIKey of [1-(2-pyridin-2-yl-1,3-thiazol-4-yl)cyclopropyl]methanol?
The InChIKey is NYAXYZSKMKOMCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2OS/c15-8-12(4-5-12)10-7-16-11(14-10)9-3-1-2-6-13-9/h1-3,6-7,15H,4-5,8H2.
What are the key properties of [1-(2-pyridin-2-yl-1,3-thiazol-4-yl)cyclopropyl]methanol?
[1-(2-pyridin-2-yl-1,3-thiazol-4-yl)cyclopropyl]methanol has a molecular weight of 232.31 g/mol, XLogP of 2.23, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-pyridin-2-yl-1,3-thiazol-4-yl)cyclopropyl]methanol is sourced from PubChem (CID 116890867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).