(2-methoxy-1,3-thiazol-4-yl)-(2-methylcyclopropyl)methanol

C9H13NO2S — CID 130571343

IUPAC(2-methoxy-1,3-thiazol-4-yl)-(2-methylcyclopropyl)methanol
SMILESCOc1nc(C(O)C2CC2C)cs1
InChIInChI=1S/C9H13NO2S/c1-5-3-6(5)8(11)7-4-13-9(10-7)12-2/h4-6,8,11H,3H2,1-2H3
InChIKeyXJFXNCIEENDROC-UHFFFAOYSA-N
MW199.28 g/mol
LogP1.84
Rot. Bonds3

About (2-methoxy-1,3-thiazol-4-yl)-(2-methylcyclopropyl)methanol

(2-methoxy-1,3-thiazol-4-yl)-(2-methylcyclopropyl)methanol (PubChem CID 130571343) has the molecular formula C9H13NO2S and a molecular weight of 199.28 g/mol. Its IUPAC name is (2-methoxy-1,3-thiazol-4-yl)-(2-methylcyclopropyl)methanol.

Molecular Properties

Compound Name(2-methoxy-1,3-thiazol-4-yl)-(2-methylcyclopropyl)methanol
PubChem CID130571343
Molecular FormulaC9H13NO2S
Molecular Weight199.28 g/mol
Exact Mass199.07
IUPAC Name(2-methoxy-1,3-thiazol-4-yl)-(2-methylcyclopropyl)methanol
SMILESCOc1nc(C(O)C2CC2C)cs1
InChIInChI=1S/C9H13NO2S/c1-5-3-6(5)8(11)7-4-13-9(10-7)12-2/h4-6,8,11H,3H2,1-2H3
InChIKeyXJFXNCIEENDROC-UHFFFAOYSA-N
XLogP1.84
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.28
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2-methoxy-1,3-thiazol-4-yl)-pyrrolidin-2-ylmethanol
CID 126982766
2-methoxy-4-propan-2-yl-1,3-thiazole
CID 18736803
(2-fluoro-1-methylcyclopropyl)-(2-methoxy-1,3-thiazol-4-yl)methanol
CID 130854845
(2,2-dimethylcyclopropyl)-(2-methoxy-1,3-thiazol-4-yl)methanamine
CID 130571376
(3-methoxy-1,2-thiazol-5-yl)-(2-methylcyclopropyl)methanol
CID 130730400
2-(2-methoxy-1,3-thiazol-4-yl)propan-1-amine
CID 82598532
4-(5-chloro-2-methylcyclohexyl)-2-methoxy-1,3-thiazole
CID 165496494
(2,6-dimethoxyphenyl)-(2-methylcyclopropyl)methanol
CID 116810169
(4-methoxy-3-pyridinyl)-(2-methylcyclopropyl)methanol
CID 130565651
3-(2-methoxy-1,3-thiazol-4-yl)-4-methylthiolan-3-ol
CID 130571277
(5-chloro-2-methoxyphenyl)-(2-methylcyclopropyl)methanol
CID 65420387
ethane;2-methoxy-4-(4-methylphenyl)-1,3-thiazole
CID 145078481

Frequently Asked Questions

What is the IUPAC name of (2-methoxy-1,3-thiazol-4-yl)-(2-methylcyclopropyl)methanol?
The IUPAC name of (2-methoxy-1,3-thiazol-4-yl)-(2-methylcyclopropyl)methanol (CID 130571343) is (2-methoxy-1,3-thiazol-4-yl)-(2-methylcyclopropyl)methanol.
What is the SMILES notation for (2-methoxy-1,3-thiazol-4-yl)-(2-methylcyclopropyl)methanol?
The canonical SMILES for (2-methoxy-1,3-thiazol-4-yl)-(2-methylcyclopropyl)methanol is COc1nc(C(O)C2CC2C)cs1.
What is the InChIKey of (2-methoxy-1,3-thiazol-4-yl)-(2-methylcyclopropyl)methanol?
The InChIKey is XJFXNCIEENDROC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13NO2S/c1-5-3-6(5)8(11)7-4-13-9(10-7)12-2/h4-6,8,11H,3H2,1-2H3.
What are the key properties of (2-methoxy-1,3-thiazol-4-yl)-(2-methylcyclopropyl)methanol?
(2-methoxy-1,3-thiazol-4-yl)-(2-methylcyclopropyl)methanol has a molecular weight of 199.28 g/mol, XLogP of 1.84, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methoxy-1,3-thiazol-4-yl)-(2-methylcyclopropyl)methanol is sourced from PubChem (CID 130571343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).