[1-(2-cyclohexyl-1,3-thiazol-4-yl)cyclobutyl]methanamine

C14H22N2S — CID 116890992

IUPAC[1-(2-cyclohexyl-1,3-thiazol-4-yl)cyclobutyl]methanamine
SMILESNCC1(c2csc(C3CCCCC3)n2)CCC1
InChIInChI=1S/C14H22N2S/c15-10-14(7-4-8-14)12-9-17-13(16-12)11-5-2-1-3-6-11/h9,11H,1-8,10,15H2
InChIKeyJSZHDGLKOKNCJJ-UHFFFAOYSA-N
MW250.41 g/mol
LogP3.57
Rot. Bonds3

About [1-(2-cyclohexyl-1,3-thiazol-4-yl)cyclobutyl]methanamine

[1-(2-cyclohexyl-1,3-thiazol-4-yl)cyclobutyl]methanamine (PubChem CID 116890992) has the molecular formula C14H22N2S and a molecular weight of 250.41 g/mol. Its IUPAC name is [1-(2-cyclohexyl-1,3-thiazol-4-yl)cyclobutyl]methanamine.

Molecular Properties

Compound Name[1-(2-cyclohexyl-1,3-thiazol-4-yl)cyclobutyl]methanamine
PubChem CID116890992
Molecular FormulaC14H22N2S
Molecular Weight250.41 g/mol
Exact Mass250.15
IUPAC Name[1-(2-cyclohexyl-1,3-thiazol-4-yl)cyclobutyl]methanamine
SMILESNCC1(c2csc(C3CCCCC3)n2)CCC1
InChIInChI=1S/C14H22N2S/c15-10-14(7-4-8-14)12-9-17-13(16-12)11-5-2-1-3-6-11/h9,11H,1-8,10,15H2
InChIKeyJSZHDGLKOKNCJJ-UHFFFAOYSA-N
XLogP3.57
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.41
LogP ≤ 53.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze [1-(2-cyclohexyl-1,3-thiazol-4-yl)cyclobutyl]methanamine 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

[1-[2-(oxan-4-yl)-1,3-thiazol-4-yl]cyclopropyl]methanamine
CID 116890896
[1-(2-methyl-1,3-thiazol-4-yl)cyclobutyl]methanamine
CID 82601461
[1-[2-(1-methylpyrrolidin-3-yl)-1,3-thiazol-4-yl]cyclobutyl]methanol
CID 116891068
1-(2-cyclooctyl-1,3-thiazol-4-yl)ethanamine
CID 80609462
3-(2-cyclopentyl-1,3-thiazol-4-yl)-2-methylpropan-1-amine
CID 116888387
4-(4-cyclohexyl-1,3-thiazol-2-yl)cyclohexan-1-amine
CID 116965467
3-(2-cyclopentyl-1,3-thiazol-4-yl)-3-methylbutan-1-amine
CID 116888466
4-(2-cyclohexyl-1,3-thiazol-4-yl)-2-methylbutan-2-amine
CID 116888534
[1-(2-cyclohexylphenyl)cyclobutyl]methanamine
CID 117360932
1-(2-cyclohexyl-1,3-thiazol-4-yl)-N-methylmethanamine
CID 61280857
1-[2-(oxan-4-yl)-1,3-thiazol-4-yl]cyclobutane-1-carboxylic acid
CID 116891034
2,4-di(cyclobutyl)-1,3-thiazole
CID 130688661

Frequently Asked Questions

What is the IUPAC name of [1-(2-cyclohexyl-1,3-thiazol-4-yl)cyclobutyl]methanamine?
The IUPAC name of [1-(2-cyclohexyl-1,3-thiazol-4-yl)cyclobutyl]methanamine (CID 116890992) is [1-(2-cyclohexyl-1,3-thiazol-4-yl)cyclobutyl]methanamine.
What is the SMILES notation for [1-(2-cyclohexyl-1,3-thiazol-4-yl)cyclobutyl]methanamine?
The canonical SMILES for [1-(2-cyclohexyl-1,3-thiazol-4-yl)cyclobutyl]methanamine is NCC1(c2csc(C3CCCCC3)n2)CCC1.
What is the InChIKey of [1-(2-cyclohexyl-1,3-thiazol-4-yl)cyclobutyl]methanamine?
The InChIKey is JSZHDGLKOKNCJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2S/c15-10-14(7-4-8-14)12-9-17-13(16-12)11-5-2-1-3-6-11/h9,11H,1-8,10,15H2.
What are the key properties of [1-(2-cyclohexyl-1,3-thiazol-4-yl)cyclobutyl]methanamine?
[1-(2-cyclohexyl-1,3-thiazol-4-yl)cyclobutyl]methanamine has a molecular weight of 250.41 g/mol, XLogP of 3.57, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-cyclohexyl-1,3-thiazol-4-yl)cyclobutyl]methanamine is sourced from PubChem (CID 116890992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).