N-(4-ethylcyclohexyl)-4-methyl-1,3-thiazol-2-amine

C12H20N2S — CID 61470076

IUPACN-(4-ethylcyclohexyl)-4-methyl-1,3-thiazol-2-amine
SMILESCCC1CCC(Nc2nc(C)cs2)CC1
InChIInChI=1S/C12H20N2S/c1-3-10-4-6-11(7-5-10)14-12-13-9(2)8-15-12/h8,10-11H,3-7H2,1-2H3,(H,13,14)
InChIKeyLZEFRUJIESHFRP-UHFFFAOYSA-N
MW224.37 g/mol
LogP3.83
Rot. Bonds3

About N-(4-ethylcyclohexyl)-4-methyl-1,3-thiazol-2-amine

N-(4-ethylcyclohexyl)-4-methyl-1,3-thiazol-2-amine (PubChem CID 61470076) has the molecular formula C12H20N2S and a molecular weight of 224.37 g/mol. Its IUPAC name is N-(4-ethylcyclohexyl)-4-methyl-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN-(4-ethylcyclohexyl)-4-methyl-1,3-thiazol-2-amine
PubChem CID61470076
Molecular FormulaC12H20N2S
Molecular Weight224.37 g/mol
Exact Mass224.13
IUPAC NameN-(4-ethylcyclohexyl)-4-methyl-1,3-thiazol-2-amine
SMILESCCC1CCC(Nc2nc(C)cs2)CC1
InChIInChI=1S/C12H20N2S/c1-3-10-4-6-11(7-5-10)14-12-13-9(2)8-15-12/h8,10-11H,3-7H2,1-2H3,(H,13,14)
InChIKeyLZEFRUJIESHFRP-UHFFFAOYSA-N
XLogP3.83
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.37
LogP ≤ 53.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of N-(4-ethylcyclohexyl)-4-methyl-1,3-thiazol-2-amine?
The IUPAC name of N-(4-ethylcyclohexyl)-4-methyl-1,3-thiazol-2-amine (CID 61470076) is N-(4-ethylcyclohexyl)-4-methyl-1,3-thiazol-2-amine.
What is the SMILES notation for N-(4-ethylcyclohexyl)-4-methyl-1,3-thiazol-2-amine?
The canonical SMILES for N-(4-ethylcyclohexyl)-4-methyl-1,3-thiazol-2-amine is CCC1CCC(Nc2nc(C)cs2)CC1.
What is the InChIKey of N-(4-ethylcyclohexyl)-4-methyl-1,3-thiazol-2-amine?
The InChIKey is LZEFRUJIESHFRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2S/c1-3-10-4-6-11(7-5-10)14-12-13-9(2)8-15-12/h8,10-11H,3-7H2,1-2H3,(H,13,14).
What are the key properties of N-(4-ethylcyclohexyl)-4-methyl-1,3-thiazol-2-amine?
N-(4-ethylcyclohexyl)-4-methyl-1,3-thiazol-2-amine has a molecular weight of 224.37 g/mol, XLogP of 3.83, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethylcyclohexyl)-4-methyl-1,3-thiazol-2-amine is sourced from PubChem (CID 61470076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).