2-cyclohexyl-N-methyl-1-(2-methyl-1,3-thiazol-4-yl)ethanamine

C13H22N2S — CID 105135487

IUPAC2-cyclohexyl-N-methyl-1-(2-methyl-1,3-thiazol-4-yl)ethanamine
SMILESCNC(CC1CCCCC1)c1csc(C)n1
InChIInChI=1S/C13H22N2S/c1-10-15-13(9-16-10)12(14-2)8-11-6-4-3-5-7-11/h9,11-12,14H,3-8H2,1-2H3
InChIKeyQFNPQIHSJDFCFN-UHFFFAOYSA-N
MW238.40 g/mol
LogP3.68
Rot. Bonds4

About 2-cyclohexyl-N-methyl-1-(2-methyl-1,3-thiazol-4-yl)ethanamine

2-cyclohexyl-N-methyl-1-(2-methyl-1,3-thiazol-4-yl)ethanamine (PubChem CID 105135487) has the molecular formula C13H22N2S and a molecular weight of 238.40 g/mol. Its IUPAC name is 2-cyclohexyl-N-methyl-1-(2-methyl-1,3-thiazol-4-yl)ethanamine.

Molecular Properties

Compound Name2-cyclohexyl-N-methyl-1-(2-methyl-1,3-thiazol-4-yl)ethanamine
PubChem CID105135487
Molecular FormulaC13H22N2S
Molecular Weight238.40 g/mol
Exact Mass238.15
IUPAC Name2-cyclohexyl-N-methyl-1-(2-methyl-1,3-thiazol-4-yl)ethanamine
SMILESCNC(CC1CCCCC1)c1csc(C)n1
InChIInChI=1S/C13H22N2S/c1-10-15-13(9-16-10)12(14-2)8-11-6-4-3-5-7-11/h9,11-12,14H,3-8H2,1-2H3
InChIKeyQFNPQIHSJDFCFN-UHFFFAOYSA-N
XLogP3.68
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.40
LogP ≤ 53.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-cyclohexylethyl)-1-(2-methyl-1,3-thiazol-4-yl)ethanamine
CID 54932016
1-(3-ethylcyclohexyl)-N-methyl-1-(2-methyl-1,3-thiazol-4-yl)methanamine
CID 105156041
2-cyclopentyl-N-methyl-1-(5-methylthiophen-3-yl)ethanamine
CID 104991619
N-(cyclobutylmethyl)-1-(2-methyl-1,3-thiazol-4-yl)ethanamine
CID 43670306
2-(1-cyclopentylpyrazol-3-yl)-N-methyl-1-(2-methyl-1,3-thiazol-4-yl)ethanamine
CID 105157013
N-methyl-1-(2-methyl-1,3-thiazol-4-yl)pentan-1-amine
CID 105125168
2-cyclopentyl-1-(2,6-dimethyl-4-pyridinyl)-N-methylethanamine
CID 107503517
N-methyl-1-(2-methyl-1,3-thiazol-4-yl)-2-phenylethanamine
CID 105084395
1-cycloheptyl-N-ethyl-3-(2-methyl-1,3-thiazol-4-yl)propan-2-amine
CID 104997127
4-(cyclohexylmethyl)-2-methyl-1,3-thiazole
CID 174858890
N-methyl-3-methylsulfonyl-1-(2-methyl-1,3-thiazol-4-yl)propan-1-amine
CID 114984071
cyclobutyl-(2-methyl-1,3-thiazol-4-yl)methanamine
CID 83684011

Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-N-methyl-1-(2-methyl-1,3-thiazol-4-yl)ethanamine?
The IUPAC name of 2-cyclohexyl-N-methyl-1-(2-methyl-1,3-thiazol-4-yl)ethanamine (CID 105135487) is 2-cyclohexyl-N-methyl-1-(2-methyl-1,3-thiazol-4-yl)ethanamine.
What is the SMILES notation for 2-cyclohexyl-N-methyl-1-(2-methyl-1,3-thiazol-4-yl)ethanamine?
The canonical SMILES for 2-cyclohexyl-N-methyl-1-(2-methyl-1,3-thiazol-4-yl)ethanamine is CNC(CC1CCCCC1)c1csc(C)n1.
What is the InChIKey of 2-cyclohexyl-N-methyl-1-(2-methyl-1,3-thiazol-4-yl)ethanamine?
The InChIKey is QFNPQIHSJDFCFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2S/c1-10-15-13(9-16-10)12(14-2)8-11-6-4-3-5-7-11/h9,11-12,14H,3-8H2,1-2H3.
What are the key properties of 2-cyclohexyl-N-methyl-1-(2-methyl-1,3-thiazol-4-yl)ethanamine?
2-cyclohexyl-N-methyl-1-(2-methyl-1,3-thiazol-4-yl)ethanamine has a molecular weight of 238.40 g/mol, XLogP of 3.68, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-N-methyl-1-(2-methyl-1,3-thiazol-4-yl)ethanamine is sourced from PubChem (CID 105135487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).