1-(2,2-dimethylcyclohexyl)-N-methyl-2-(1,3-thiazol-2-yl)ethanamine

C14H24N2S — CID 107190116

IUPAC1-(2,2-dimethylcyclohexyl)-N-methyl-2-(1,3-thiazol-2-yl)ethanamine
SMILESCNC(Cc1nccs1)C1CCCCC1(C)C
InChIInChI=1S/C14H24N2S/c1-14(2)7-5-4-6-11(14)12(15-3)10-13-16-8-9-17-13/h8-9,11-12,15H,4-7,10H2,1-3H3
InChIKeyHOUIOSZJIOBZRT-UHFFFAOYSA-N
MW252.43 g/mol
LogP3.49
Rot. Bonds4

About 1-(2,2-dimethylcyclohexyl)-N-methyl-2-(1,3-thiazol-2-yl)ethanamine

1-(2,2-dimethylcyclohexyl)-N-methyl-2-(1,3-thiazol-2-yl)ethanamine (PubChem CID 107190116) has the molecular formula C14H24N2S and a molecular weight of 252.43 g/mol. Its IUPAC name is 1-(2,2-dimethylcyclohexyl)-N-methyl-2-(1,3-thiazol-2-yl)ethanamine.

Molecular Properties

Compound Name1-(2,2-dimethylcyclohexyl)-N-methyl-2-(1,3-thiazol-2-yl)ethanamine
PubChem CID107190116
Molecular FormulaC14H24N2S
Molecular Weight252.43 g/mol
Exact Mass252.17
IUPAC Name1-(2,2-dimethylcyclohexyl)-N-methyl-2-(1,3-thiazol-2-yl)ethanamine
SMILESCNC(Cc1nccs1)C1CCCCC1(C)C
InChIInChI=1S/C14H24N2S/c1-14(2)7-5-4-6-11(14)12(15-3)10-13-16-8-9-17-13/h8-9,11-12,15H,4-7,10H2,1-3H3
InChIKeyHOUIOSZJIOBZRT-UHFFFAOYSA-N
XLogP3.49
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.43
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(6-bicyclo[3.1.0]hexanyl)-N-methyl-2-(1,3-thiazol-2-yl)ethanamine
CID 105014878
1-(2,2-dimethylcyclohexyl)-N-methyl-2-(1-methylimidazol-2-yl)ethanamine
CID 107189965
1-(2,2-dimethylcyclopentyl)-N-methyl-2-thiophen-2-ylethanamine
CID 107179492
1-(2,2-dimethylcyclohexyl)-N-methylpropan-1-amine
CID 79852591
1-(2,2-dimethylcyclohexyl)-2-(4-methoxyphenyl)-N-methylethanamine
CID 107179500
[1-cycloheptyl-2-(1,3-thiazol-2-yl)ethyl]hydrazine
CID 105232079
[1-cyclooctyl-2-(1,3-thiazol-2-yl)ethyl]hydrazine
CID 105255195
N-[1-cyclopentyl-2-(1,3-thiazol-2-yl)ethyl]propan-1-amine
CID 79825132
2-(5-chlorothiophen-2-yl)-1-(2,2-dimethylcyclopentyl)-N-methylethanamine
CID 107188272
[1-(7-bicyclo[4.1.0]heptanyl)-2-(1,3-thiazol-2-yl)ethyl]hydrazine
CID 105324654
1-(1-methoxycyclohexyl)-N-methyl-2-(1,3-thiazol-2-yl)ethanamine
CID 116762857
1-(2,2-dimethylcyclopentyl)-N-methyl-2-(4-propan-2-ylphenyl)ethanamine
CID 107188347

Frequently Asked Questions

What is the IUPAC name of 1-(2,2-dimethylcyclohexyl)-N-methyl-2-(1,3-thiazol-2-yl)ethanamine?
The IUPAC name of 1-(2,2-dimethylcyclohexyl)-N-methyl-2-(1,3-thiazol-2-yl)ethanamine (CID 107190116) is 1-(2,2-dimethylcyclohexyl)-N-methyl-2-(1,3-thiazol-2-yl)ethanamine.
What is the SMILES notation for 1-(2,2-dimethylcyclohexyl)-N-methyl-2-(1,3-thiazol-2-yl)ethanamine?
The canonical SMILES for 1-(2,2-dimethylcyclohexyl)-N-methyl-2-(1,3-thiazol-2-yl)ethanamine is CNC(Cc1nccs1)C1CCCCC1(C)C.
What is the InChIKey of 1-(2,2-dimethylcyclohexyl)-N-methyl-2-(1,3-thiazol-2-yl)ethanamine?
The InChIKey is HOUIOSZJIOBZRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2S/c1-14(2)7-5-4-6-11(14)12(15-3)10-13-16-8-9-17-13/h8-9,11-12,15H,4-7,10H2,1-3H3.
What are the key properties of 1-(2,2-dimethylcyclohexyl)-N-methyl-2-(1,3-thiazol-2-yl)ethanamine?
1-(2,2-dimethylcyclohexyl)-N-methyl-2-(1,3-thiazol-2-yl)ethanamine has a molecular weight of 252.43 g/mol, XLogP of 3.49, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,2-dimethylcyclohexyl)-N-methyl-2-(1,3-thiazol-2-yl)ethanamine is sourced from PubChem (CID 107190116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).