(2-methylcyclopentyl)-(3-methyl-1,2-thiazol-5-yl)methanol

C11H17NOS — CID 130752209

IUPAC(2-methylcyclopentyl)-(3-methyl-1,2-thiazol-5-yl)methanol
SMILESCc1cc(C(O)C2CCCC2C)sn1
InChIInChI=1S/C11H17NOS/c1-7-4-3-5-9(7)11(13)10-6-8(2)12-14-10/h6-7,9,11,13H,3-5H2,1-2H3
InChIKeyXUMATAAJMCATFT-UHFFFAOYSA-N
MW211.33 g/mol
LogP2.92
Rot. Bonds2

About (2-methylcyclopentyl)-(3-methyl-1,2-thiazol-5-yl)methanol

(2-methylcyclopentyl)-(3-methyl-1,2-thiazol-5-yl)methanol (PubChem CID 130752209) has the molecular formula C11H17NOS and a molecular weight of 211.33 g/mol. Its IUPAC name is (2-methylcyclopentyl)-(3-methyl-1,2-thiazol-5-yl)methanol.

Molecular Properties

Compound Name(2-methylcyclopentyl)-(3-methyl-1,2-thiazol-5-yl)methanol
PubChem CID130752209
Molecular FormulaC11H17NOS
Molecular Weight211.33 g/mol
Exact Mass211.10
IUPAC Name(2-methylcyclopentyl)-(3-methyl-1,2-thiazol-5-yl)methanol
SMILESCc1cc(C(O)C2CCCC2C)sn1
InChIInChI=1S/C11H17NOS/c1-7-4-3-5-9(7)11(13)10-6-8(2)12-14-10/h6-7,9,11,13H,3-5H2,1-2H3
InChIKeyXUMATAAJMCATFT-UHFFFAOYSA-N
XLogP2.92
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.33
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2-methylcyclopentyl)-(3-methyl-1,2-thiazol-5-yl)methanol?
The IUPAC name of (2-methylcyclopentyl)-(3-methyl-1,2-thiazol-5-yl)methanol (CID 130752209) is (2-methylcyclopentyl)-(3-methyl-1,2-thiazol-5-yl)methanol.
What is the SMILES notation for (2-methylcyclopentyl)-(3-methyl-1,2-thiazol-5-yl)methanol?
The canonical SMILES for (2-methylcyclopentyl)-(3-methyl-1,2-thiazol-5-yl)methanol is Cc1cc(C(O)C2CCCC2C)sn1.
What is the InChIKey of (2-methylcyclopentyl)-(3-methyl-1,2-thiazol-5-yl)methanol?
The InChIKey is XUMATAAJMCATFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NOS/c1-7-4-3-5-9(7)11(13)10-6-8(2)12-14-10/h6-7,9,11,13H,3-5H2,1-2H3.
What are the key properties of (2-methylcyclopentyl)-(3-methyl-1,2-thiazol-5-yl)methanol?
(2-methylcyclopentyl)-(3-methyl-1,2-thiazol-5-yl)methanol has a molecular weight of 211.33 g/mol, XLogP of 2.92, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methylcyclopentyl)-(3-methyl-1,2-thiazol-5-yl)methanol is sourced from PubChem (CID 130752209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).