5-methyl-1-(4-methyl-1,3-thiazol-5-yl)hexan-1-ol

C11H19NOS — CID 105122728

IUPAC5-methyl-1-(4-methyl-1,3-thiazol-5-yl)hexan-1-ol
SMILESCc1ncsc1C(O)CCCC(C)C
InChIInChI=1S/C11H19NOS/c1-8(2)5-4-6-10(13)11-9(3)12-7-14-11/h7-8,10,13H,4-6H2,1-3H3
InChIKeyLWMUSYZHWLTQNT-UHFFFAOYSA-N
MW213.35 g/mol
LogP3.31
Rot. Bonds5

About 5-methyl-1-(4-methyl-1,3-thiazol-5-yl)hexan-1-ol

5-methyl-1-(4-methyl-1,3-thiazol-5-yl)hexan-1-ol (PubChem CID 105122728) has the molecular formula C11H19NOS and a molecular weight of 213.35 g/mol. Its IUPAC name is 5-methyl-1-(4-methyl-1,3-thiazol-5-yl)hexan-1-ol.

Molecular Properties

Compound Name5-methyl-1-(4-methyl-1,3-thiazol-5-yl)hexan-1-ol
PubChem CID105122728
Molecular FormulaC11H19NOS
Molecular Weight213.35 g/mol
Exact Mass213.12
IUPAC Name5-methyl-1-(4-methyl-1,3-thiazol-5-yl)hexan-1-ol
SMILESCc1ncsc1C(O)CCCC(C)C
InChIInChI=1S/C11H19NOS/c1-8(2)5-4-6-10(13)11-9(3)12-7-14-11/h7-8,10,13H,4-6H2,1-3H3
InChIKeyLWMUSYZHWLTQNT-UHFFFAOYSA-N
XLogP3.31
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.35
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(4-methyl-1,3-thiazol-5-yl)nonan-1-ol
CID 105085734
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CID 101008965
2-cyclopentyl-1-(4-methyl-1,3-thiazol-5-yl)ethanol
CID 105090377
2-(5-ethylthiophen-2-yl)-1-(4-methyl-1,3-thiazol-5-yl)ethanol
CID 105087638
2-(4-chloro-2-fluorophenyl)-1-(4-methyl-1,3-thiazol-5-yl)ethanol
CID 105132939
4-methyl-5-(7-methyl-3-methylideneoctyl)-1,3-thiazole
CID 155442020
N-methyl-1-(4-methyl-1,3-thiazol-5-yl)undecan-1-amine
CID 105138249
1-(4-methyl-1,3-thiazol-5-yl)pentylhydrazine
CID 105293729
2-(2-chloro-3-fluorophenyl)-1-(4-methyl-1,3-thiazol-5-yl)ethanol
CID 105124092
[5,5,5-trifluoro-1-(4-methyl-1,3-thiazol-5-yl)pentyl]hydrazine
CID 105328896
1-methoxy-4-[1-(4-methyl-1,3-thiazol-5-yl)ethylamino]butan-2-ol
CID 115897163
1-[1-(4-methyl-1,3-thiazol-5-yl)ethylamino]butan-2-ol
CID 104579913

Frequently Asked Questions

What is the IUPAC name of 5-methyl-1-(4-methyl-1,3-thiazol-5-yl)hexan-1-ol?
The IUPAC name of 5-methyl-1-(4-methyl-1,3-thiazol-5-yl)hexan-1-ol (CID 105122728) is 5-methyl-1-(4-methyl-1,3-thiazol-5-yl)hexan-1-ol.
What is the SMILES notation for 5-methyl-1-(4-methyl-1,3-thiazol-5-yl)hexan-1-ol?
The canonical SMILES for 5-methyl-1-(4-methyl-1,3-thiazol-5-yl)hexan-1-ol is Cc1ncsc1C(O)CCCC(C)C.
What is the InChIKey of 5-methyl-1-(4-methyl-1,3-thiazol-5-yl)hexan-1-ol?
The InChIKey is LWMUSYZHWLTQNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NOS/c1-8(2)5-4-6-10(13)11-9(3)12-7-14-11/h7-8,10,13H,4-6H2,1-3H3.
What are the key properties of 5-methyl-1-(4-methyl-1,3-thiazol-5-yl)hexan-1-ol?
5-methyl-1-(4-methyl-1,3-thiazol-5-yl)hexan-1-ol has a molecular weight of 213.35 g/mol, XLogP of 3.31, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-1-(4-methyl-1,3-thiazol-5-yl)hexan-1-ol is sourced from PubChem (CID 105122728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).