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

C11H18N2OS — CID 116782578

IUPAC2-(1-methoxy-3-methylcyclohexyl)-1,3-thiazol-4-amine
SMILESCOC1(c2nc(N)cs2)CCCC(C)C1
InChIInChI=1S/C11H18N2OS/c1-8-4-3-5-11(6-8,14-2)10-13-9(12)7-15-10/h7-8H,3-6,12H2,1-2H3
InChIKeyOZBBQXJWWINNII-UHFFFAOYSA-N
MW226.34 g/mol
LogP2.78
Rot. Bonds2

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

2-(1-methoxy-3-methylcyclohexyl)-1,3-thiazol-4-amine (PubChem CID 116782578) has the molecular formula C11H18N2OS and a molecular weight of 226.34 g/mol. Its IUPAC name is 2-(1-methoxy-3-methylcyclohexyl)-1,3-thiazol-4-amine.

Molecular Properties

Compound Name2-(1-methoxy-3-methylcyclohexyl)-1,3-thiazol-4-amine
PubChem CID116782578
Molecular FormulaC11H18N2OS
Molecular Weight226.34 g/mol
Exact Mass226.11
IUPAC Name2-(1-methoxy-3-methylcyclohexyl)-1,3-thiazol-4-amine
SMILESCOC1(c2nc(N)cs2)CCCC(C)C1
InChIInChI=1S/C11H18N2OS/c1-8-4-3-5-11(6-8,14-2)10-13-9(12)7-15-10/h7-8H,3-6,12H2,1-2H3
InChIKeyOZBBQXJWWINNII-UHFFFAOYSA-N
XLogP2.78
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.34
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-ethyl-1-[2-(1-methoxy-3-methylcyclohexyl)-1,3-thiazol-4-yl]ethanamine
CID 116774601
2-(1-methoxy-3-methylcyclohexyl)-5-methyl-1,3-thiazol-4-amine
CID 116782598
2-(1-ethoxycyclopentyl)-1,3-thiazol-4-amine
CID 116782573
2-(1-ethoxy-3-methylcyclohexyl)-4-propan-2-yl-1,3-thiazole
CID 116782722
1-[2-(1-methoxy-3-methylcyclohexyl)-4-methyl-1,3-thiazol-5-yl]ethanamine
CID 116774230
N-[1-[2-(1-ethoxy-3-methylcyclohexyl)-1,3-thiazol-4-yl]ethyl]propan-1-amine
CID 116774617
N-[[2-(1-ethoxy-3-methylcyclohexyl)-1,3-thiazol-4-yl]methyl]ethanamine
CID 116774721
[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
ethyl 2-(1-methoxy-3-methylcyclohexyl)-5-methyl-1,3-thiazole-4-carboxylate
CID 116744479
2-(1-methoxy-3-methylcyclohexyl)-5,6-dihydro-4H-1,3-benzothiazol-7-one
CID 116774139
[2-(1-methoxycyclobutyl)-1,3-thiazol-4-yl]methanamine
CID 116727873

Frequently Asked Questions

What is the IUPAC name of 2-(1-methoxy-3-methylcyclohexyl)-1,3-thiazol-4-amine?
The IUPAC name of 2-(1-methoxy-3-methylcyclohexyl)-1,3-thiazol-4-amine (CID 116782578) is 2-(1-methoxy-3-methylcyclohexyl)-1,3-thiazol-4-amine.
What is the SMILES notation for 2-(1-methoxy-3-methylcyclohexyl)-1,3-thiazol-4-amine?
The canonical SMILES for 2-(1-methoxy-3-methylcyclohexyl)-1,3-thiazol-4-amine is COC1(c2nc(N)cs2)CCCC(C)C1.
What is the InChIKey of 2-(1-methoxy-3-methylcyclohexyl)-1,3-thiazol-4-amine?
The InChIKey is OZBBQXJWWINNII-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2OS/c1-8-4-3-5-11(6-8,14-2)10-13-9(12)7-15-10/h7-8H,3-6,12H2,1-2H3.
What are the key properties of 2-(1-methoxy-3-methylcyclohexyl)-1,3-thiazol-4-amine?
2-(1-methoxy-3-methylcyclohexyl)-1,3-thiazol-4-amine has a molecular weight of 226.34 g/mol, XLogP of 2.78, 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)-1,3-thiazol-4-amine is sourced from PubChem (CID 116782578), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).