cyclopropyl-(3-methoxy-1,2-thiazol-5-yl)methanol

C8H11NO2S — CID 130748192

IUPACcyclopropyl-(3-methoxy-1,2-thiazol-5-yl)methanol
SMILESCOc1cc(C(O)C2CC2)sn1
InChIInChI=1S/C8H11NO2S/c1-11-7-4-6(12-9-7)8(10)5-2-3-5/h4-5,8,10H,2-3H2,1H3
InChIKeyJVJQMJMSVVFORT-UHFFFAOYSA-N
MW185.25 g/mol
LogP1.60
Rot. Bonds3

About cyclopropyl-(3-methoxy-1,2-thiazol-5-yl)methanol

cyclopropyl-(3-methoxy-1,2-thiazol-5-yl)methanol (PubChem CID 130748192) has the molecular formula C8H11NO2S and a molecular weight of 185.25 g/mol. Its IUPAC name is cyclopropyl-(3-methoxy-1,2-thiazol-5-yl)methanol.

Molecular Properties

Compound Namecyclopropyl-(3-methoxy-1,2-thiazol-5-yl)methanol
PubChem CID130748192
Molecular FormulaC8H11NO2S
Molecular Weight185.25 g/mol
Exact Mass185.05
IUPAC Namecyclopropyl-(3-methoxy-1,2-thiazol-5-yl)methanol
SMILESCOc1cc(C(O)C2CC2)sn1
InChIInChI=1S/C8H11NO2S/c1-11-7-4-6(12-9-7)8(10)5-2-3-5/h4-5,8,10H,2-3H2,1H3
InChIKeyJVJQMJMSVVFORT-UHFFFAOYSA-N
XLogP1.60
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.25
LogP ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(3-methoxy-1,2-thiazol-5-yl)-(2-methylcyclopropyl)methanol
CID 130730400
(3-methoxy-1,2-thiazol-5-yl)-pyrrolidin-2-ylmethanol
CID 130673824
1-(3-methoxy-1,2-thiazol-5-yl)but-3-yn-1-ol
CID 131036535
3-methoxy-5-propan-2-yl-1,2-thiazole
CID 58942655
1-(3-methoxy-1,2-thiazol-5-yl)-2-methylpropane-1,2-diol
CID 130748198
N-[1-(3-methoxy-1,2-thiazol-5-yl)ethyl]acetamide
CID 157037131
(3-methoxy-1,2-thiazol-5-yl)-(1H-pyrrol-2-yl)methanamine
CID 130987719
cyclobutyl-(6-methoxypyrimidin-4-yl)methanol
CID 102950436
3-(3-methoxy-1,2-thiazol-5-yl)cyclopent-2-en-1-ol
CID 126999945
(4-methylcyclohexyl)-(1,2-thiazol-5-yl)methanol
CID 131059678
(2-amino-5-methoxyphenyl)-cyclopropylmethanol
CID 105447147
6-bicyclo[3.1.0]hexanyl-(3-methyl-1,2-thiazol-5-yl)methanol
CID 130639381

Frequently Asked Questions

What is the IUPAC name of cyclopropyl-(3-methoxy-1,2-thiazol-5-yl)methanol?
The IUPAC name of cyclopropyl-(3-methoxy-1,2-thiazol-5-yl)methanol (CID 130748192) is cyclopropyl-(3-methoxy-1,2-thiazol-5-yl)methanol.
What is the SMILES notation for cyclopropyl-(3-methoxy-1,2-thiazol-5-yl)methanol?
The canonical SMILES for cyclopropyl-(3-methoxy-1,2-thiazol-5-yl)methanol is COc1cc(C(O)C2CC2)sn1.
What is the InChIKey of cyclopropyl-(3-methoxy-1,2-thiazol-5-yl)methanol?
The InChIKey is JVJQMJMSVVFORT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11NO2S/c1-11-7-4-6(12-9-7)8(10)5-2-3-5/h4-5,8,10H,2-3H2,1H3.
What are the key properties of cyclopropyl-(3-methoxy-1,2-thiazol-5-yl)methanol?
cyclopropyl-(3-methoxy-1,2-thiazol-5-yl)methanol has a molecular weight of 185.25 g/mol, XLogP of 1.60, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopropyl-(3-methoxy-1,2-thiazol-5-yl)methanol is sourced from PubChem (CID 130748192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).