2-cyclohexyl-5-methyl-1,3-thiazole

C10H15NS — CID 83382378

IUPAC2-cyclohexyl-5-methyl-1,3-thiazole
SMILESCc1cnc(C2CCCCC2)s1
InChIInChI=1S/C10H15NS/c1-8-7-11-10(12-8)9-5-3-2-4-6-9/h7,9H,2-6H2,1H3
InChIKeyQSLPGSJGZHZEIJ-UHFFFAOYSA-N
MW181.30 g/mol
LogP3.50
Rot. Bonds1

About 2-cyclohexyl-5-methyl-1,3-thiazole

2-cyclohexyl-5-methyl-1,3-thiazole (PubChem CID 83382378) has the molecular formula C10H15NS and a molecular weight of 181.30 g/mol. Its IUPAC name is 2-cyclohexyl-5-methyl-1,3-thiazole.

Molecular Properties

Compound Name2-cyclohexyl-5-methyl-1,3-thiazole
PubChem CID83382378
Molecular FormulaC10H15NS
Molecular Weight181.30 g/mol
Exact Mass181.09
IUPAC Name2-cyclohexyl-5-methyl-1,3-thiazole
SMILESCc1cnc(C2CCCCC2)s1
InChIInChI=1S/C10H15NS/c1-8-7-11-10(12-8)9-5-3-2-4-6-9/h7,9H,2-6H2,1H3
InChIKeyQSLPGSJGZHZEIJ-UHFFFAOYSA-N
XLogP3.50
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.30
LogP ≤ 53.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-5-methyl-1,3-thiazole?
The IUPAC name of 2-cyclohexyl-5-methyl-1,3-thiazole (CID 83382378) is 2-cyclohexyl-5-methyl-1,3-thiazole.
What is the SMILES notation for 2-cyclohexyl-5-methyl-1,3-thiazole?
The canonical SMILES for 2-cyclohexyl-5-methyl-1,3-thiazole is Cc1cnc(C2CCCCC2)s1.
What is the InChIKey of 2-cyclohexyl-5-methyl-1,3-thiazole?
The InChIKey is QSLPGSJGZHZEIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NS/c1-8-7-11-10(12-8)9-5-3-2-4-6-9/h7,9H,2-6H2,1H3.
What are the key properties of 2-cyclohexyl-5-methyl-1,3-thiazole?
2-cyclohexyl-5-methyl-1,3-thiazole has a molecular weight of 181.30 g/mol, XLogP of 3.50, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-5-methyl-1,3-thiazole is sourced from PubChem (CID 83382378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).