(1-ethylcyclopropyl)-(1,2-thiazol-3-yl)methanol

C9H13NOS — CID 130699304

IUPAC(1-ethylcyclopropyl)-(1,2-thiazol-3-yl)methanol
SMILESCCC1(C(O)c2ccsn2)CC1
InChIInChI=1S/C9H13NOS/c1-2-9(4-5-9)8(11)7-3-6-12-10-7/h3,6,8,11H,2,4-5H2,1H3
InChIKeyLIAAKDRVDZKEFI-UHFFFAOYSA-N
MW183.28 g/mol
LogP2.37
Rot. Bonds3

About (1-ethylcyclopropyl)-(1,2-thiazol-3-yl)methanol

(1-ethylcyclopropyl)-(1,2-thiazol-3-yl)methanol (PubChem CID 130699304) has the molecular formula C9H13NOS and a molecular weight of 183.28 g/mol. Its IUPAC name is (1-ethylcyclopropyl)-(1,2-thiazol-3-yl)methanol.

Molecular Properties

Compound Name(1-ethylcyclopropyl)-(1,2-thiazol-3-yl)methanol
PubChem CID130699304
Molecular FormulaC9H13NOS
Molecular Weight183.28 g/mol
Exact Mass183.07
IUPAC Name(1-ethylcyclopropyl)-(1,2-thiazol-3-yl)methanol
SMILESCCC1(C(O)c2ccsn2)CC1
InChIInChI=1S/C9H13NOS/c1-2-9(4-5-9)8(11)7-3-6-12-10-7/h3,6,8,11H,2,4-5H2,1H3
InChIKeyLIAAKDRVDZKEFI-UHFFFAOYSA-N
XLogP2.37
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.28
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(Isothiazol-3-yl)ethanol
CID 19017861
4-Methyl-1-(1,2-thiazol-3-yl)pent-3-en-2-ol
CID 67596526
(1S)-1-(1,2-thiazol-3-yl)ethanol
CID 118480475
1-(1,2-Thiazol-3-yl)butan-1-ol
CID 130642506
2-(1,2-Thiazol-3-yl)propan-2-ol
CID 119097575
3-Methyl-2-(1,2-thiazol-3-yl)butan-2-ol
CID 126985702
(2,2,3,3-Tetramethylcyclopropyl)-(1,2-thiazol-3-yl)methanol
CID 126985705
2,2,3,3-Tetramethyl-1-(1,2-thiazol-3-yl)butan-1-ol
CID 126985711
1-[Hydroxy(1,2-thiazol-3-yl)methyl]cyclopentan-1-ol
CID 126985713
1-[Hydroxy(1,2-thiazol-3-yl)methyl]cyclohexan-1-ol
CID 126985714
3,3-Dimethyl-1-(1,2-thiazol-3-yl)butane-1,2-diol
CID 126985715
1-Cyclopropyl-2-(1,2-thiazol-3-yl)propan-2-ol
CID 126985747

Frequently Asked Questions

What is the IUPAC name of (1-ethylcyclopropyl)-(1,2-thiazol-3-yl)methanol?
The IUPAC name of (1-ethylcyclopropyl)-(1,2-thiazol-3-yl)methanol (CID 130699304) is (1-ethylcyclopropyl)-(1,2-thiazol-3-yl)methanol.
What is the SMILES notation for (1-ethylcyclopropyl)-(1,2-thiazol-3-yl)methanol?
The canonical SMILES for (1-ethylcyclopropyl)-(1,2-thiazol-3-yl)methanol is CCC1(C(O)c2ccsn2)CC1.
What is the InChIKey of (1-ethylcyclopropyl)-(1,2-thiazol-3-yl)methanol?
The InChIKey is LIAAKDRVDZKEFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13NOS/c1-2-9(4-5-9)8(11)7-3-6-12-10-7/h3,6,8,11H,2,4-5H2,1H3.
What are the key properties of (1-ethylcyclopropyl)-(1,2-thiazol-3-yl)methanol?
(1-ethylcyclopropyl)-(1,2-thiazol-3-yl)methanol has a molecular weight of 183.28 g/mol, XLogP of 2.37, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1-ethylcyclopropyl)-(1,2-thiazol-3-yl)methanol is sourced from PubChem (CID 130699304), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).