4-(6-methoxyhexyl)-1,3-thiazole

C10H17NOS — CID 67276018

IUPAC4-(6-methoxyhexyl)-1,3-thiazole
SMILESCOCCCCCCc1cscn1
InChIInChI=1S/C10H17NOS/c1-12-7-5-3-2-4-6-10-8-13-9-11-10/h8-9H,2-7H2,1H3
InChIKeyQEDSJMXKSRSXKK-UHFFFAOYSA-N
MW199.32 g/mol
LogP2.89
Rot. Bonds7

About 4-(6-methoxyhexyl)-1,3-thiazole

4-(6-methoxyhexyl)-1,3-thiazole (PubChem CID 67276018) has the molecular formula C10H17NOS and a molecular weight of 199.32 g/mol. Its IUPAC name is 4-(6-methoxyhexyl)-1,3-thiazole.

Molecular Properties

Compound Name4-(6-methoxyhexyl)-1,3-thiazole
PubChem CID67276018
Molecular FormulaC10H17NOS
Molecular Weight199.32 g/mol
Exact Mass199.10
IUPAC Name4-(6-methoxyhexyl)-1,3-thiazole
SMILESCOCCCCCCc1cscn1
InChIInChI=1S/C10H17NOS/c1-12-7-5-3-2-4-6-10-8-13-9-11-10/h8-9H,2-7H2,1H3
InChIKeyQEDSJMXKSRSXKK-UHFFFAOYSA-N
XLogP2.89
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.32
LogP ≤ 52.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 4-(6-methoxyhexyl)-1,3-thiazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-heptyl-1,3-thiazole;octane
CID 91422595
4-(2-methoxyethoxy)-N-(1,3-thiazol-4-ylmethyl)butan-1-amine
CID 115600125
1-methoxy-4-methyl-N-[2-(1,3-thiazol-4-yl)ethyl]pentan-3-amine
CID 115731950
4-[3-(2,6-difluorophenoxy)propyl]-1,3-thiazole
CID 141135135
2-(2-methoxyethylamino)-N-[2-(1,3-thiazol-4-yl)ethyl]acetamide
CID 79281124
3-[4-(1,3-thiazol-4-yl)butoxy]propyl N-octadecan-3-ylcarbamate
CID 57107544
4-[2-(4-fluorophenoxy)ethyl]-1,3-thiazole
CID 142639749
4-(dimethylphosphoryloxymethyl)-1,3-thiazole
CID 123710075
2-[2-methoxyethyl-[2-(1,3-thiazol-4-yl)ethylcarbamoyl]amino]acetic acid
CID 79271368
5-(5-methoxypentyl)-1,2,4-oxadiazole
CID 67274675
4-(fluoromethyl)-1,3-thiazole
CID 76551954
1-(2-methoxyethyl)-N-(1,3-thiazol-4-ylmethyl)imidazol-2-amine
CID 106572554

Frequently Asked Questions

What is the IUPAC name of 4-(6-methoxyhexyl)-1,3-thiazole?
The IUPAC name of 4-(6-methoxyhexyl)-1,3-thiazole (CID 67276018) is 4-(6-methoxyhexyl)-1,3-thiazole.
What is the SMILES notation for 4-(6-methoxyhexyl)-1,3-thiazole?
The canonical SMILES for 4-(6-methoxyhexyl)-1,3-thiazole is COCCCCCCc1cscn1.
What is the InChIKey of 4-(6-methoxyhexyl)-1,3-thiazole?
The InChIKey is QEDSJMXKSRSXKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NOS/c1-12-7-5-3-2-4-6-10-8-13-9-11-10/h8-9H,2-7H2,1H3.
What are the key properties of 4-(6-methoxyhexyl)-1,3-thiazole?
4-(6-methoxyhexyl)-1,3-thiazole has a molecular weight of 199.32 g/mol, XLogP of 2.89, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(6-methoxyhexyl)-1,3-thiazole is sourced from PubChem (CID 67276018), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).