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

C6H9NOS — CID 15785702

IUPAC1-(1,3-thiazol-2-yl)propan-1-ol
SMILESCCC(O)c1nccs1
InChIInChI=1S/C6H9NOS/c1-2-5(8)6-7-3-4-9-6/h3-5,8H,2H2,1H3
InChIKeyVRCSHNZIEDOOBA-UHFFFAOYSA-N
MW143.21 g/mol
LogP1.59
Rot. Bonds2

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

1-(1,3-thiazol-2-yl)propan-1-ol (PubChem CID 15785702) has the molecular formula C6H9NOS and a molecular weight of 143.21 g/mol. Its IUPAC name is 1-(1,3-thiazol-2-yl)propan-1-ol.

Molecular Properties

Compound Name1-(1,3-thiazol-2-yl)propan-1-ol
PubChem CID15785702
Molecular FormulaC6H9NOS
Molecular Weight143.21 g/mol
Exact Mass143.04
IUPAC Name1-(1,3-thiazol-2-yl)propan-1-ol
SMILESCCC(O)c1nccs1
InChIInChI=1S/C6H9NOS/c1-2-5(8)6-7-3-4-9-6/h3-5,8H,2H2,1H3
InChIKeyVRCSHNZIEDOOBA-UHFFFAOYSA-N
XLogP1.59
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.21
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(1,3-thiazol-2-yl)propan-1-ol?
The IUPAC name of 1-(1,3-thiazol-2-yl)propan-1-ol (CID 15785702) is 1-(1,3-thiazol-2-yl)propan-1-ol.
What is the SMILES notation for 1-(1,3-thiazol-2-yl)propan-1-ol?
The canonical SMILES for 1-(1,3-thiazol-2-yl)propan-1-ol is CCC(O)c1nccs1.
What is the InChIKey of 1-(1,3-thiazol-2-yl)propan-1-ol?
The InChIKey is VRCSHNZIEDOOBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9NOS/c1-2-5(8)6-7-3-4-9-6/h3-5,8H,2H2,1H3.
What are the key properties of 1-(1,3-thiazol-2-yl)propan-1-ol?
1-(1,3-thiazol-2-yl)propan-1-ol has a molecular weight of 143.21 g/mol, XLogP of 1.59, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1,3-thiazol-2-yl)propan-1-ol is sourced from PubChem (CID 15785702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).