2-cyclopropyl-1-(1,2-thiazol-3-yl)propan-1-ol

C9H13NOS — CID 130718298

IUPAC2-cyclopropyl-1-(1,2-thiazol-3-yl)propan-1-ol
SMILESCC(C1CC1)C(O)c1ccsn1
InChIInChI=1S/C9H13NOS/c1-6(7-2-3-7)9(11)8-4-5-12-10-8/h4-7,9,11H,2-3H2,1H3
InChIKeyKTQUTWKHILBTDH-UHFFFAOYSA-N
MW183.28 g/mol
LogP2.22
Rot. Bonds3

About 2-cyclopropyl-1-(1,2-thiazol-3-yl)propan-1-ol

2-cyclopropyl-1-(1,2-thiazol-3-yl)propan-1-ol (PubChem CID 130718298) has the molecular formula C9H13NOS and a molecular weight of 183.28 g/mol. Its IUPAC name is 2-cyclopropyl-1-(1,2-thiazol-3-yl)propan-1-ol.

Molecular Properties

Compound Name2-cyclopropyl-1-(1,2-thiazol-3-yl)propan-1-ol
PubChem CID130718298
Molecular FormulaC9H13NOS
Molecular Weight183.28 g/mol
Exact Mass183.07
IUPAC Name2-cyclopropyl-1-(1,2-thiazol-3-yl)propan-1-ol
SMILESCC(C1CC1)C(O)c1ccsn1
InChIInChI=1S/C9H13NOS/c1-6(7-2-3-7)9(11)8-4-5-12-10-8/h4-7,9,11H,2-3H2,1H3
InChIKeyKTQUTWKHILBTDH-UHFFFAOYSA-N
XLogP2.22
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 ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4,4-Difluoro-1-(1,2-thiazol-3-yl)cyclohex-2-en-1-ol
CID 165492024
(1S,2R)-2-amino-4-methyl-1-(1,2-thiazol-3-yl)pentan-1-ol
CID 70041804
1-(1,2-Thiazol-3-yl)butan-1-ol
CID 130642506
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
Cyclopropyl(1,2-thiazol-3-yl)methanol
CID 127002567
2-Methoxy-2-methyl-1-(1,2-thiazol-3-yl)propan-1-ol
CID 127002572

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-1-(1,2-thiazol-3-yl)propan-1-ol?
The IUPAC name of 2-cyclopropyl-1-(1,2-thiazol-3-yl)propan-1-ol (CID 130718298) is 2-cyclopropyl-1-(1,2-thiazol-3-yl)propan-1-ol.
What is the SMILES notation for 2-cyclopropyl-1-(1,2-thiazol-3-yl)propan-1-ol?
The canonical SMILES for 2-cyclopropyl-1-(1,2-thiazol-3-yl)propan-1-ol is CC(C1CC1)C(O)c1ccsn1.
What is the InChIKey of 2-cyclopropyl-1-(1,2-thiazol-3-yl)propan-1-ol?
The InChIKey is KTQUTWKHILBTDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13NOS/c1-6(7-2-3-7)9(11)8-4-5-12-10-8/h4-7,9,11H,2-3H2,1H3.
What are the key properties of 2-cyclopropyl-1-(1,2-thiazol-3-yl)propan-1-ol?
2-cyclopropyl-1-(1,2-thiazol-3-yl)propan-1-ol has a molecular weight of 183.28 g/mol, XLogP of 2.22, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-1-(1,2-thiazol-3-yl)propan-1-ol is sourced from PubChem (CID 130718298), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).