2-(1,2-thiazol-5-yl)cyclohexan-1-ol

C9H13NOS — CID 130829137

IUPAC2-(1,2-thiazol-5-yl)cyclohexan-1-ol
SMILESOC1CCCCC1c1ccns1
InChIInChI=1S/C9H13NOS/c11-8-4-2-1-3-7(8)9-5-6-10-12-9/h5-8,11H,1-4H2
InChIKeySLAOTMLEZGMJHB-UHFFFAOYSA-N
MW183.28 g/mol
LogP2.16
Rot. Bonds1

About 2-(1,2-thiazol-5-yl)cyclohexan-1-ol

2-(1,2-thiazol-5-yl)cyclohexan-1-ol (PubChem CID 130829137) has the molecular formula C9H13NOS and a molecular weight of 183.28 g/mol. Its IUPAC name is 2-(1,2-thiazol-5-yl)cyclohexan-1-ol.

Molecular Properties

Compound Name2-(1,2-thiazol-5-yl)cyclohexan-1-ol
PubChem CID130829137
Molecular FormulaC9H13NOS
Molecular Weight183.28 g/mol
Exact Mass183.07
IUPAC Name2-(1,2-thiazol-5-yl)cyclohexan-1-ol
SMILESOC1CCCCC1c1ccns1
InChIInChI=1S/C9H13NOS/c11-8-4-2-1-3-7(8)9-5-6-10-12-9/h5-8,11H,1-4H2
InChIKeySLAOTMLEZGMJHB-UHFFFAOYSA-N
XLogP2.16
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.28
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(1,2-thiazol-5-yl)cyclohexan-1-ol?
The IUPAC name of 2-(1,2-thiazol-5-yl)cyclohexan-1-ol (CID 130829137) is 2-(1,2-thiazol-5-yl)cyclohexan-1-ol.
What is the SMILES notation for 2-(1,2-thiazol-5-yl)cyclohexan-1-ol?
The canonical SMILES for 2-(1,2-thiazol-5-yl)cyclohexan-1-ol is OC1CCCCC1c1ccns1.
What is the InChIKey of 2-(1,2-thiazol-5-yl)cyclohexan-1-ol?
The InChIKey is SLAOTMLEZGMJHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13NOS/c11-8-4-2-1-3-7(8)9-5-6-10-12-9/h5-8,11H,1-4H2.
What are the key properties of 2-(1,2-thiazol-5-yl)cyclohexan-1-ol?
2-(1,2-thiazol-5-yl)cyclohexan-1-ol has a molecular weight of 183.28 g/mol, XLogP of 2.16, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,2-thiazol-5-yl)cyclohexan-1-ol is sourced from PubChem (CID 130829137), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).