[1-(4-methyl-2-pyridin-2-yl-1,3-thiazol-5-yl)cyclobutyl]methanol

C14H16N2OS — CID 116887020

IUPAC[1-(4-methyl-2-pyridin-2-yl-1,3-thiazol-5-yl)cyclobutyl]methanol
SMILESCc1nc(-c2ccccn2)sc1C1(CO)CCC1
InChIInChI=1S/C14H16N2OS/c1-10-12(14(9-17)6-4-7-14)18-13(16-10)11-5-2-3-8-15-11/h2-3,5,8,17H,4,6-7,9H2,1H3
InChIKeyWLUZCHMJZHOYOG-UHFFFAOYSA-N
MW260.36 g/mol
LogP2.93
Rot. Bonds3

About [1-(4-methyl-2-pyridin-2-yl-1,3-thiazol-5-yl)cyclobutyl]methanol

[1-(4-methyl-2-pyridin-2-yl-1,3-thiazol-5-yl)cyclobutyl]methanol (PubChem CID 116887020) has the molecular formula C14H16N2OS and a molecular weight of 260.36 g/mol. Its IUPAC name is [1-(4-methyl-2-pyridin-2-yl-1,3-thiazol-5-yl)cyclobutyl]methanol.

Molecular Properties

Compound Name[1-(4-methyl-2-pyridin-2-yl-1,3-thiazol-5-yl)cyclobutyl]methanol
PubChem CID116887020
Molecular FormulaC14H16N2OS
Molecular Weight260.36 g/mol
Exact Mass260.10
IUPAC Name[1-(4-methyl-2-pyridin-2-yl-1,3-thiazol-5-yl)cyclobutyl]methanol
SMILESCc1nc(-c2ccccn2)sc1C1(CO)CCC1
InChIInChI=1S/C14H16N2OS/c1-10-12(14(9-17)6-4-7-14)18-13(16-10)11-5-2-3-8-15-11/h2-3,5,8,17H,4,6-7,9H2,1H3
InChIKeyWLUZCHMJZHOYOG-UHFFFAOYSA-N
XLogP2.93
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.36
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[3-(4-methyl-2-pyridin-2-yl-1,3-thiazol-5-yl)oxetan-3-yl]methanol
CID 116887096
[1-[4-methyl-2-(1H-pyrrol-2-yl)-1,3-thiazol-5-yl]cyclobutyl]methanol
CID 136988709
[1-[4-methyl-2-(5-methylfuran-2-yl)-1,3-thiazol-5-yl]cyclobutyl]methanol
CID 116887023
[1-(4-methyl-6-pyridin-2-ylpyrimidin-2-yl)cyclobutyl]methanol
CID 116896211
4,5-dimethyl-2-pyridin-2-yl-1,3-thiazole
CID 58923237
[1-(2-pyridin-2-yl-1,3-thiazol-4-yl)cyclopropyl]methanol
CID 116890867
5-bromo-4-methyl-2-pyridin-2-yl-1,3-thiazole
CID 75532062
N-cyclopropyl-2-(4-methyl-2-pyridin-2-yl-1,3-thiazol-5-yl)acetamide
CID 110328901
1-(azepan-1-yl)-2-(4-methyl-2-pyridin-2-yl-1,3-thiazol-5-yl)ethanone
CID 110328975
3-amino-3-(4-methyl-2-pyridin-2-yl-1,3-thiazol-5-yl)propanoic acid
CID 116886784
N-benzyl-4-methyl-2-pyridin-2-yl-1,3-thiazole-5-carboxamide
CID 9138512
N-cyclopentyl-N-ethyl-4-methyl-2-pyridin-2-yl-1,3-thiazole-5-carboxamide
CID 134060937

Frequently Asked Questions

What is the IUPAC name of [1-(4-methyl-2-pyridin-2-yl-1,3-thiazol-5-yl)cyclobutyl]methanol?
The IUPAC name of [1-(4-methyl-2-pyridin-2-yl-1,3-thiazol-5-yl)cyclobutyl]methanol (CID 116887020) is [1-(4-methyl-2-pyridin-2-yl-1,3-thiazol-5-yl)cyclobutyl]methanol.
What is the SMILES notation for [1-(4-methyl-2-pyridin-2-yl-1,3-thiazol-5-yl)cyclobutyl]methanol?
The canonical SMILES for [1-(4-methyl-2-pyridin-2-yl-1,3-thiazol-5-yl)cyclobutyl]methanol is Cc1nc(-c2ccccn2)sc1C1(CO)CCC1.
What is the InChIKey of [1-(4-methyl-2-pyridin-2-yl-1,3-thiazol-5-yl)cyclobutyl]methanol?
The InChIKey is WLUZCHMJZHOYOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2OS/c1-10-12(14(9-17)6-4-7-14)18-13(16-10)11-5-2-3-8-15-11/h2-3,5,8,17H,4,6-7,9H2,1H3.
What are the key properties of [1-(4-methyl-2-pyridin-2-yl-1,3-thiazol-5-yl)cyclobutyl]methanol?
[1-(4-methyl-2-pyridin-2-yl-1,3-thiazol-5-yl)cyclobutyl]methanol has a molecular weight of 260.36 g/mol, XLogP of 2.93, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(4-methyl-2-pyridin-2-yl-1,3-thiazol-5-yl)cyclobutyl]methanol is sourced from PubChem (CID 116887020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).