2-cyclopentyl-3-(4-methyl-1,3-thiazol-2-yl)propan-1-ol

C12H19NOS — CID 112570284

IUPAC2-cyclopentyl-3-(4-methyl-1,3-thiazol-2-yl)propan-1-ol
SMILESCc1csc(CC(CO)C2CCCC2)n1
InChIInChI=1S/C12H19NOS/c1-9-8-15-12(13-9)6-11(7-14)10-4-2-3-5-10/h8,10-11,14H,2-7H2,1H3
InChIKeyXGVGHIHGBDEPGH-UHFFFAOYSA-N
MW225.36 g/mol
LogP2.79
Rot. Bonds4

About 2-cyclopentyl-3-(4-methyl-1,3-thiazol-2-yl)propan-1-ol

2-cyclopentyl-3-(4-methyl-1,3-thiazol-2-yl)propan-1-ol (PubChem CID 112570284) has the molecular formula C12H19NOS and a molecular weight of 225.36 g/mol. Its IUPAC name is 2-cyclopentyl-3-(4-methyl-1,3-thiazol-2-yl)propan-1-ol.

Molecular Properties

Compound Name2-cyclopentyl-3-(4-methyl-1,3-thiazol-2-yl)propan-1-ol
PubChem CID112570284
Molecular FormulaC12H19NOS
Molecular Weight225.36 g/mol
Exact Mass225.12
IUPAC Name2-cyclopentyl-3-(4-methyl-1,3-thiazol-2-yl)propan-1-ol
SMILESCc1csc(CC(CO)C2CCCC2)n1
InChIInChI=1S/C12H19NOS/c1-9-8-15-12(13-9)6-11(7-14)10-4-2-3-5-10/h8,10-11,14H,2-7H2,1H3
InChIKeyXGVGHIHGBDEPGH-UHFFFAOYSA-N
XLogP2.79
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.36
LogP ≤ 52.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-ethylcyclohexyl)-2-(4-methyl-1,3-thiazol-2-yl)ethanamine
CID 55252390
2-(2-cyclopentylethyl)-4-methyl-1,3-thiazole
CID 101058674
1-(4-methyl-1,3-thiazol-2-yl)-4-(oxan-2-yl)butan-2-ol
CID 115824182
1-(4-methyl-1,3-thiazol-2-yl)butane-2,3-diol
CID 103452784
ethane;(4-methyl-1,3-thiazol-2-yl)methanol
CID 144707130
1-(2-aminocyclohexyl)-2-(4-methyl-1,3-thiazol-2-yl)ethanone
CID 116579981
1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-2-(4-methyl-1,3-thiazol-2-yl)ethanamine
CID 112681099
[1-(4,4-dimethylcyclohexyl)-2-(4-methyl-1,3-thiazol-2-yl)ethyl]hydrazine
CID 105231723
3-methyl-1-(4-methyl-1,3-thiazol-2-yl)butan-2-amine
CID 62797218
3-amino-3-methyl-1-(4-methyl-1,3-thiazol-2-yl)butan-2-ol
CID 130589293
[1-(4-methyl-1,3-thiazol-2-yl)-3-(oxolan-2-yl)propan-2-yl]hydrazine
CID 105198617
N-[1-(2-ethylcyclohexyl)-2-(4-methyl-1,3-thiazol-2-yl)ethyl]propan-1-amine
CID 63863284

Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-3-(4-methyl-1,3-thiazol-2-yl)propan-1-ol?
The IUPAC name of 2-cyclopentyl-3-(4-methyl-1,3-thiazol-2-yl)propan-1-ol (CID 112570284) is 2-cyclopentyl-3-(4-methyl-1,3-thiazol-2-yl)propan-1-ol.
What is the SMILES notation for 2-cyclopentyl-3-(4-methyl-1,3-thiazol-2-yl)propan-1-ol?
The canonical SMILES for 2-cyclopentyl-3-(4-methyl-1,3-thiazol-2-yl)propan-1-ol is Cc1csc(CC(CO)C2CCCC2)n1.
What is the InChIKey of 2-cyclopentyl-3-(4-methyl-1,3-thiazol-2-yl)propan-1-ol?
The InChIKey is XGVGHIHGBDEPGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19NOS/c1-9-8-15-12(13-9)6-11(7-14)10-4-2-3-5-10/h8,10-11,14H,2-7H2,1H3.
What are the key properties of 2-cyclopentyl-3-(4-methyl-1,3-thiazol-2-yl)propan-1-ol?
2-cyclopentyl-3-(4-methyl-1,3-thiazol-2-yl)propan-1-ol has a molecular weight of 225.36 g/mol, XLogP of 2.79, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-3-(4-methyl-1,3-thiazol-2-yl)propan-1-ol is sourced from PubChem (CID 112570284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).