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

C13H23NOS — CID 105085734

IUPAC1-(4-methyl-1,3-thiazol-5-yl)nonan-1-ol
SMILESCCCCCCCCC(O)c1scnc1C
InChIInChI=1S/C13H23NOS/c1-3-4-5-6-7-8-9-12(15)13-11(2)14-10-16-13/h10,12,15H,3-9H2,1-2H3
InChIKeyPFBJOSCNKVESPM-UHFFFAOYSA-N
MW241.40 g/mol
LogP4.24
Rot. Bonds8

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

1-(4-methyl-1,3-thiazol-5-yl)nonan-1-ol (PubChem CID 105085734) has the molecular formula C13H23NOS and a molecular weight of 241.40 g/mol. Its IUPAC name is 1-(4-methyl-1,3-thiazol-5-yl)nonan-1-ol.

Molecular Properties

Compound Name1-(4-methyl-1,3-thiazol-5-yl)nonan-1-ol
PubChem CID105085734
Molecular FormulaC13H23NOS
Molecular Weight241.40 g/mol
Exact Mass241.15
IUPAC Name1-(4-methyl-1,3-thiazol-5-yl)nonan-1-ol
SMILESCCCCCCCCC(O)c1scnc1C
InChIInChI=1S/C13H23NOS/c1-3-4-5-6-7-8-9-12(15)13-11(2)14-10-16-13/h10,12,15H,3-9H2,1-2H3
InChIKeyPFBJOSCNKVESPM-UHFFFAOYSA-N
XLogP4.24
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.40
LogP ≤ 54.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

5-methyl-1-(4-methyl-1,3-thiazol-5-yl)hexan-1-ol
CID 105122728
N-methyl-1-(4-methyl-1,3-thiazol-5-yl)undecan-1-amine
CID 105138249
(1R)-2-chloro-1-(4-methyl-1,3-thiazol-5-yl)ethanol
CID 101008965
1-(4-methyl-1,3-thiazol-5-yl)pentylhydrazine
CID 105293729
1-(3-methylthiophen-2-yl)tridecan-1-ol
CID 65148369
N-ethyl-1-(4-methyl-1,3-thiazol-5-yl)pentan-1-amine
CID 105125558
2-(5-ethylthiophen-2-yl)-1-(4-methyl-1,3-thiazol-5-yl)ethanol
CID 105087638
1-(1,3-thiazol-2-yl)octan-1-ol
CID 10943825
2-cyclopentyl-1-(4-methyl-1,3-thiazol-5-yl)ethanol
CID 105090377
N-ethyl-2-methyl-1-(4-methyl-1,3-thiazol-5-yl)pentan-1-amine
CID 107893638
1-(3-chloro-4-methylthiophen-2-yl)hexan-1-ol
CID 103407894
1-(3-chlorothiophen-2-yl)tridecan-1-ol
CID 115789521

Frequently Asked Questions

What is the IUPAC name of 1-(4-methyl-1,3-thiazol-5-yl)nonan-1-ol?
The IUPAC name of 1-(4-methyl-1,3-thiazol-5-yl)nonan-1-ol (CID 105085734) is 1-(4-methyl-1,3-thiazol-5-yl)nonan-1-ol.
What is the SMILES notation for 1-(4-methyl-1,3-thiazol-5-yl)nonan-1-ol?
The canonical SMILES for 1-(4-methyl-1,3-thiazol-5-yl)nonan-1-ol is CCCCCCCCC(O)c1scnc1C.
What is the InChIKey of 1-(4-methyl-1,3-thiazol-5-yl)nonan-1-ol?
The InChIKey is PFBJOSCNKVESPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23NOS/c1-3-4-5-6-7-8-9-12(15)13-11(2)14-10-16-13/h10,12,15H,3-9H2,1-2H3.
What are the key properties of 1-(4-methyl-1,3-thiazol-5-yl)nonan-1-ol?
1-(4-methyl-1,3-thiazol-5-yl)nonan-1-ol has a molecular weight of 241.40 g/mol, XLogP of 4.24, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methyl-1,3-thiazol-5-yl)nonan-1-ol is sourced from PubChem (CID 105085734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).