3-methyl-N-[1-(1,3-thiazol-5-yl)ethyl]cyclohexan-1-amine

C12H20N2S — CID 115712862

IUPAC3-methyl-N-[1-(1,3-thiazol-5-yl)ethyl]cyclohexan-1-amine
SMILESCC1CCCC(NC(C)c2cncs2)C1
InChIInChI=1S/C12H20N2S/c1-9-4-3-5-11(6-9)14-10(2)12-7-13-8-15-12/h7-11,14H,3-6H2,1-2H3
InChIKeyVQPDAEKMUKHMFL-UHFFFAOYSA-N
MW224.37 g/mol
LogP3.37
Rot. Bonds3

About 3-methyl-N-[1-(1,3-thiazol-5-yl)ethyl]cyclohexan-1-amine

3-methyl-N-[1-(1,3-thiazol-5-yl)ethyl]cyclohexan-1-amine (PubChem CID 115712862) has the molecular formula C12H20N2S and a molecular weight of 224.37 g/mol. Its IUPAC name is 3-methyl-N-[1-(1,3-thiazol-5-yl)ethyl]cyclohexan-1-amine.

Molecular Properties

Compound Name3-methyl-N-[1-(1,3-thiazol-5-yl)ethyl]cyclohexan-1-amine
PubChem CID115712862
Molecular FormulaC12H20N2S
Molecular Weight224.37 g/mol
Exact Mass224.13
IUPAC Name3-methyl-N-[1-(1,3-thiazol-5-yl)ethyl]cyclohexan-1-amine
SMILESCC1CCCC(NC(C)c2cncs2)C1
InChIInChI=1S/C12H20N2S/c1-9-4-3-5-11(6-9)14-10(2)12-7-13-8-15-12/h7-11,14H,3-6H2,1-2H3
InChIKeyVQPDAEKMUKHMFL-UHFFFAOYSA-N
XLogP3.37
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.37
LogP ≤ 53.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-methyl-N-[1-(1,3-thiazol-5-yl)ethyl]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

Related Compounds

N-[1-(1,3-thiazol-5-yl)ethyl]-1,2,3,5,6,7,8,8a-octahydroindolizin-7-amine
CID 113260246
N-[1-(4-iodophenyl)ethyl]-3-methylcyclohexan-1-amine
CID 43775452
2-[1-(1,3-thiazol-5-yl)ethylamino]cyclohexan-1-ol
CID 115720070
1-cyclopropyl-N-[1-(1,3-thiazol-5-yl)ethyl]pyrrolidin-3-amine
CID 115717113
3-methyl-N-[(1R)-1-phenylethyl]cyclohexan-1-amine
CID 12731669
2-ethyl-N-[1-(1,3-thiazol-5-yl)ethyl]cyclopropan-1-amine
CID 103783780
3-methyl-N-[(1S)-1-pyridin-2-ylethyl]cyclohexan-1-amine
CID 81402334
1-cyclopropyl-N-[1-(1,3-thiazol-5-yl)ethyl]ethanamine
CID 115707513
2-[4-[1-(1,3-thiazol-5-yl)ethylamino]piperidin-1-yl]acetamide
CID 113260068
N-[1-(4-bromophenyl)ethyl]-3-methylcyclohexan-1-amine
CID 43215999
1,7,7-trimethyl-N-[1-(1,3-thiazol-5-yl)ethyl]bicyclo[2.2.1]heptan-2-amine
CID 115707288
3-methyl-N-[1-(2-methylphenyl)ethyl]cyclohexan-1-amine
CID 43081561

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-[1-(1,3-thiazol-5-yl)ethyl]cyclohexan-1-amine?
The IUPAC name of 3-methyl-N-[1-(1,3-thiazol-5-yl)ethyl]cyclohexan-1-amine (CID 115712862) is 3-methyl-N-[1-(1,3-thiazol-5-yl)ethyl]cyclohexan-1-amine.
What is the SMILES notation for 3-methyl-N-[1-(1,3-thiazol-5-yl)ethyl]cyclohexan-1-amine?
The canonical SMILES for 3-methyl-N-[1-(1,3-thiazol-5-yl)ethyl]cyclohexan-1-amine is CC1CCCC(NC(C)c2cncs2)C1.
What is the InChIKey of 3-methyl-N-[1-(1,3-thiazol-5-yl)ethyl]cyclohexan-1-amine?
The InChIKey is VQPDAEKMUKHMFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2S/c1-9-4-3-5-11(6-9)14-10(2)12-7-13-8-15-12/h7-11,14H,3-6H2,1-2H3.
What are the key properties of 3-methyl-N-[1-(1,3-thiazol-5-yl)ethyl]cyclohexan-1-amine?
3-methyl-N-[1-(1,3-thiazol-5-yl)ethyl]cyclohexan-1-amine has a molecular weight of 224.37 g/mol, XLogP of 3.37, 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-(1,3-thiazol-5-yl)ethyl]cyclohexan-1-amine is sourced from PubChem (CID 115712862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).