2-(1-methoxy-3-methylcyclohexyl)-5-methyl-1,3-thiazol-4-amine

C12H20N2OS — CID 116782598

IUPAC2-(1-methoxy-3-methylcyclohexyl)-5-methyl-1,3-thiazol-4-amine
SMILESCOC1(c2nc(N)c(C)s2)CCCC(C)C1
InChIInChI=1S/C12H20N2OS/c1-8-5-4-6-12(7-8,15-3)11-14-10(13)9(2)16-11/h8H,4-7,13H2,1-3H3
InChIKeyHNTYXPLIAKMVMC-UHFFFAOYSA-N
MW240.37 g/mol
LogP3.09
Rot. Bonds2

About 2-(1-methoxy-3-methylcyclohexyl)-5-methyl-1,3-thiazol-4-amine

2-(1-methoxy-3-methylcyclohexyl)-5-methyl-1,3-thiazol-4-amine (PubChem CID 116782598) has the molecular formula C12H20N2OS and a molecular weight of 240.37 g/mol. Its IUPAC name is 2-(1-methoxy-3-methylcyclohexyl)-5-methyl-1,3-thiazol-4-amine.

Molecular Properties

Compound Name2-(1-methoxy-3-methylcyclohexyl)-5-methyl-1,3-thiazol-4-amine
PubChem CID116782598
Molecular FormulaC12H20N2OS
Molecular Weight240.37 g/mol
Exact Mass240.13
IUPAC Name2-(1-methoxy-3-methylcyclohexyl)-5-methyl-1,3-thiazol-4-amine
SMILESCOC1(c2nc(N)c(C)s2)CCCC(C)C1
InChIInChI=1S/C12H20N2OS/c1-8-5-4-6-12(7-8,15-3)11-14-10(13)9(2)16-11/h8H,4-7,13H2,1-3H3
InChIKeyHNTYXPLIAKMVMC-UHFFFAOYSA-N
XLogP3.09
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.37
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

ethyl 2-(1-methoxy-3-methylcyclohexyl)-5-methyl-1,3-thiazole-4-carboxylate
CID 116744479
1-[2-(1-methoxy-3-methylcyclohexyl)-4-methyl-1,3-thiazol-5-yl]ethanamine
CID 116774230
2-(1-methoxy-3-methylcyclohexyl)-1,3-thiazol-4-amine
CID 116782578
[2-(1-methoxy-3-methylcyclohexyl)-4-(trifluoromethyl)-1,3-thiazol-5-yl]methanamine
CID 116778134
2-(1-methoxy-3-methylcyclohexyl)-6-methylthieno[2,3-d]pyrimidin-4-amine
CID 116775498
N-[[2-(1-methoxy-3-methylcyclohexyl)-4-methyl-1,3-thiazol-5-yl]methyl]-2-methylpropan-2-amine
CID 116777930
2-(1-methoxy-3-methylcyclohexyl)-5,6-dihydro-4H-1,3-benzothiazol-7-one
CID 116774139
2-(1-methoxy-3-methylcyclohexyl)-6-methyl-5-propan-2-ylpyrimidin-4-amine
CID 116776210
N-ethyl-1-[2-(1-methoxy-3-methylcyclohexyl)-1,3-thiazol-4-yl]ethanamine
CID 116774601
2-(1-methoxy-3-methylcyclohexyl)-5,6-dimethyl-1H-pyrimidine-4-thione
CID 106476786
[2-(1-methoxy-3-methylcyclohexyl)-4-methylpyrimidin-5-yl]methanamine
CID 114205933
1-(4,5-dimethyl-1,3-thiazol-2-yl)-N-(2-methoxyethyl)-3-methylcyclohexan-1-amine
CID 62544284

Frequently Asked Questions

What is the IUPAC name of 2-(1-methoxy-3-methylcyclohexyl)-5-methyl-1,3-thiazol-4-amine?
The IUPAC name of 2-(1-methoxy-3-methylcyclohexyl)-5-methyl-1,3-thiazol-4-amine (CID 116782598) is 2-(1-methoxy-3-methylcyclohexyl)-5-methyl-1,3-thiazol-4-amine.
What is the SMILES notation for 2-(1-methoxy-3-methylcyclohexyl)-5-methyl-1,3-thiazol-4-amine?
The canonical SMILES for 2-(1-methoxy-3-methylcyclohexyl)-5-methyl-1,3-thiazol-4-amine is COC1(c2nc(N)c(C)s2)CCCC(C)C1.
What is the InChIKey of 2-(1-methoxy-3-methylcyclohexyl)-5-methyl-1,3-thiazol-4-amine?
The InChIKey is HNTYXPLIAKMVMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2OS/c1-8-5-4-6-12(7-8,15-3)11-14-10(13)9(2)16-11/h8H,4-7,13H2,1-3H3.
What are the key properties of 2-(1-methoxy-3-methylcyclohexyl)-5-methyl-1,3-thiazol-4-amine?
2-(1-methoxy-3-methylcyclohexyl)-5-methyl-1,3-thiazol-4-amine has a molecular weight of 240.37 g/mol, XLogP of 3.09, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-methoxy-3-methylcyclohexyl)-5-methyl-1,3-thiazol-4-amine is sourced from PubChem (CID 116782598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).