6-(4-methyl-1,3-thiazol-2-yl)hexanamide

C10H16N2OS — CID 91328470

IUPAC6-(4-methyl-1,3-thiazol-2-yl)hexanamide
SMILESCc1csc(CCCCCC(N)=O)n1
InChIInChI=1S/C10H16N2OS/c1-8-7-14-10(12-8)6-4-2-3-5-9(11)13/h7H,2-6H2,1H3,(H2,11,13)
InChIKeyYHAZRKBWLNARPS-UHFFFAOYSA-N
MW212.32 g/mol
LogP2.04
Rot. Bonds6

About 6-(4-methyl-1,3-thiazol-2-yl)hexanamide

6-(4-methyl-1,3-thiazol-2-yl)hexanamide (PubChem CID 91328470) has the molecular formula C10H16N2OS and a molecular weight of 212.32 g/mol. Its IUPAC name is 6-(4-methyl-1,3-thiazol-2-yl)hexanamide.

Molecular Properties

Compound Name6-(4-methyl-1,3-thiazol-2-yl)hexanamide
PubChem CID91328470
Molecular FormulaC10H16N2OS
Molecular Weight212.32 g/mol
Exact Mass212.10
IUPAC Name6-(4-methyl-1,3-thiazol-2-yl)hexanamide
SMILESCc1csc(CCCCCC(N)=O)n1
InChIInChI=1S/C10H16N2OS/c1-8-7-14-10(12-8)6-4-2-3-5-9(11)13/h7H,2-6H2,1H3,(H2,11,13)
InChIKeyYHAZRKBWLNARPS-UHFFFAOYSA-N
XLogP2.04
TPSA55.98 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.32
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 6-(4-methyl-1,3-thiazol-2-yl)hexanamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-(4-methyl-1,3-thiazol-2-yl)hexanamide?
The IUPAC name of 6-(4-methyl-1,3-thiazol-2-yl)hexanamide (CID 91328470) is 6-(4-methyl-1,3-thiazol-2-yl)hexanamide.
What is the SMILES notation for 6-(4-methyl-1,3-thiazol-2-yl)hexanamide?
The canonical SMILES for 6-(4-methyl-1,3-thiazol-2-yl)hexanamide is Cc1csc(CCCCCC(N)=O)n1.
What is the InChIKey of 6-(4-methyl-1,3-thiazol-2-yl)hexanamide?
The InChIKey is YHAZRKBWLNARPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2OS/c1-8-7-14-10(12-8)6-4-2-3-5-9(11)13/h7H,2-6H2,1H3,(H2,11,13).
What are the key properties of 6-(4-methyl-1,3-thiazol-2-yl)hexanamide?
6-(4-methyl-1,3-thiazol-2-yl)hexanamide has a molecular weight of 212.32 g/mol, XLogP of 2.04, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-methyl-1,3-thiazol-2-yl)hexanamide is sourced from PubChem (CID 91328470), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).