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

C12H19NOS — CID 116887012

IUPAC[1-(4-methyl-2-propan-2-yl-1,3-thiazol-5-yl)cyclobutyl]methanol
SMILESCc1nc(C(C)C)sc1C1(CO)CCC1
InChIInChI=1S/C12H19NOS/c1-8(2)11-13-9(3)10(15-11)12(7-14)5-4-6-12/h8,14H,4-7H2,1-3H3
InChIKeyOLEWUKCZAKXVER-UHFFFAOYSA-N
MW225.36 g/mol
LogP2.99
Rot. Bonds3

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

[1-(4-methyl-2-propan-2-yl-1,3-thiazol-5-yl)cyclobutyl]methanol (PubChem CID 116887012) has the molecular formula C12H19NOS and a molecular weight of 225.36 g/mol. Its IUPAC name is [1-(4-methyl-2-propan-2-yl-1,3-thiazol-5-yl)cyclobutyl]methanol.

Molecular Properties

Compound Name[1-(4-methyl-2-propan-2-yl-1,3-thiazol-5-yl)cyclobutyl]methanol
PubChem CID116887012
Molecular FormulaC12H19NOS
Molecular Weight225.36 g/mol
Exact Mass225.12
IUPAC Name[1-(4-methyl-2-propan-2-yl-1,3-thiazol-5-yl)cyclobutyl]methanol
SMILESCc1nc(C(C)C)sc1C1(CO)CCC1
InChIInChI=1S/C12H19NOS/c1-8(2)11-13-9(3)10(15-11)12(7-14)5-4-6-12/h8,14H,4-7H2,1-3H3
InChIKeyOLEWUKCZAKXVER-UHFFFAOYSA-N
XLogP2.99
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.36
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [1-(4-methyl-2-propan-2-yl-1,3-thiazol-5-yl)cyclobutyl]methanol?
The IUPAC name of [1-(4-methyl-2-propan-2-yl-1,3-thiazol-5-yl)cyclobutyl]methanol (CID 116887012) is [1-(4-methyl-2-propan-2-yl-1,3-thiazol-5-yl)cyclobutyl]methanol.
What is the SMILES notation for [1-(4-methyl-2-propan-2-yl-1,3-thiazol-5-yl)cyclobutyl]methanol?
The canonical SMILES for [1-(4-methyl-2-propan-2-yl-1,3-thiazol-5-yl)cyclobutyl]methanol is Cc1nc(C(C)C)sc1C1(CO)CCC1.
What is the InChIKey of [1-(4-methyl-2-propan-2-yl-1,3-thiazol-5-yl)cyclobutyl]methanol?
The InChIKey is OLEWUKCZAKXVER-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19NOS/c1-8(2)11-13-9(3)10(15-11)12(7-14)5-4-6-12/h8,14H,4-7H2,1-3H3.
What are the key properties of [1-(4-methyl-2-propan-2-yl-1,3-thiazol-5-yl)cyclobutyl]methanol?
[1-(4-methyl-2-propan-2-yl-1,3-thiazol-5-yl)cyclobutyl]methanol has a molecular weight of 225.36 g/mol, XLogP of 2.99, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(4-methyl-2-propan-2-yl-1,3-thiazol-5-yl)cyclobutyl]methanol is sourced from PubChem (CID 116887012), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).