3-methyl-N-(1,3-thiazol-2-ylmethyl)cyclohexan-1-amine

C11H18N2S — CID 60961816

IUPAC3-methyl-N-(1,3-thiazol-2-ylmethyl)cyclohexan-1-amine
SMILESCC1CCCC(NCc2nccs2)C1
InChIInChI=1S/C11H18N2S/c1-9-3-2-4-10(7-9)13-8-11-12-5-6-14-11/h5-6,9-10,13H,2-4,7-8H2,1H3
InChIKeyJYHCECGXDUPDOM-UHFFFAOYSA-N
MW210.35 g/mol
LogP2.81
Rot. Bonds3

About 3-methyl-N-(1,3-thiazol-2-ylmethyl)cyclohexan-1-amine

3-methyl-N-(1,3-thiazol-2-ylmethyl)cyclohexan-1-amine (PubChem CID 60961816) has the molecular formula C11H18N2S and a molecular weight of 210.35 g/mol. Its IUPAC name is 3-methyl-N-(1,3-thiazol-2-ylmethyl)cyclohexan-1-amine.

Molecular Properties

Compound Name3-methyl-N-(1,3-thiazol-2-ylmethyl)cyclohexan-1-amine
PubChem CID60961816
Molecular FormulaC11H18N2S
Molecular Weight210.35 g/mol
Exact Mass210.12
IUPAC Name3-methyl-N-(1,3-thiazol-2-ylmethyl)cyclohexan-1-amine
SMILESCC1CCCC(NCc2nccs2)C1
InChIInChI=1S/C11H18N2S/c1-9-3-2-4-10(7-9)13-8-11-12-5-6-14-11/h5-6,9-10,13H,2-4,7-8H2,1H3
InChIKeyJYHCECGXDUPDOM-UHFFFAOYSA-N
XLogP2.81
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.35
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-methyl-N-(1,3-thiazol-2-ylmethyl)cyclohexan-1-amine 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 3-methyl-N-(1,3-thiazol-2-ylmethyl)cyclohexan-1-amine?
The IUPAC name of 3-methyl-N-(1,3-thiazol-2-ylmethyl)cyclohexan-1-amine (CID 60961816) is 3-methyl-N-(1,3-thiazol-2-ylmethyl)cyclohexan-1-amine.
What is the SMILES notation for 3-methyl-N-(1,3-thiazol-2-ylmethyl)cyclohexan-1-amine?
The canonical SMILES for 3-methyl-N-(1,3-thiazol-2-ylmethyl)cyclohexan-1-amine is CC1CCCC(NCc2nccs2)C1.
What is the InChIKey of 3-methyl-N-(1,3-thiazol-2-ylmethyl)cyclohexan-1-amine?
The InChIKey is JYHCECGXDUPDOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2S/c1-9-3-2-4-10(7-9)13-8-11-12-5-6-14-11/h5-6,9-10,13H,2-4,7-8H2,1H3.
What are the key properties of 3-methyl-N-(1,3-thiazol-2-ylmethyl)cyclohexan-1-amine?
3-methyl-N-(1,3-thiazol-2-ylmethyl)cyclohexan-1-amine has a molecular weight of 210.35 g/mol, XLogP of 2.81, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-(1,3-thiazol-2-ylmethyl)cyclohexan-1-amine is sourced from PubChem (CID 60961816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).