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

C11H18N2S — CID 60759773

IUPACN-(2-ethylcyclohexyl)-1,3-thiazol-2-amine
SMILESCCC1CCCCC1Nc1nccs1
InChIInChI=1S/C11H18N2S/c1-2-9-5-3-4-6-10(9)13-11-12-7-8-14-11/h7-10H,2-6H2,1H3,(H,12,13)
InChIKeyVWTLMRINTMQXJF-UHFFFAOYSA-N
MW210.35 g/mol
LogP3.52
Rot. Bonds3

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

N-(2-ethylcyclohexyl)-1,3-thiazol-2-amine (PubChem CID 60759773) has the molecular formula C11H18N2S and a molecular weight of 210.35 g/mol. Its IUPAC name is N-(2-ethylcyclohexyl)-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN-(2-ethylcyclohexyl)-1,3-thiazol-2-amine
PubChem CID60759773
Molecular FormulaC11H18N2S
Molecular Weight210.35 g/mol
Exact Mass210.12
IUPAC NameN-(2-ethylcyclohexyl)-1,3-thiazol-2-amine
SMILESCCC1CCCCC1Nc1nccs1
InChIInChI=1S/C11H18N2S/c1-2-9-5-3-4-6-10(9)13-11-12-7-8-14-11/h7-10H,2-6H2,1H3,(H,12,13)
InChIKeyVWTLMRINTMQXJF-UHFFFAOYSA-N
XLogP3.52
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.35
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-ethylcyclohexyl)-1,3-thiazol-2-amine?
The IUPAC name of N-(2-ethylcyclohexyl)-1,3-thiazol-2-amine (CID 60759773) is N-(2-ethylcyclohexyl)-1,3-thiazol-2-amine.
What is the SMILES notation for N-(2-ethylcyclohexyl)-1,3-thiazol-2-amine?
The canonical SMILES for N-(2-ethylcyclohexyl)-1,3-thiazol-2-amine is CCC1CCCCC1Nc1nccs1.
What is the InChIKey of N-(2-ethylcyclohexyl)-1,3-thiazol-2-amine?
The InChIKey is VWTLMRINTMQXJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2S/c1-2-9-5-3-4-6-10(9)13-11-12-7-8-14-11/h7-10H,2-6H2,1H3,(H,12,13).
What are the key properties of N-(2-ethylcyclohexyl)-1,3-thiazol-2-amine?
N-(2-ethylcyclohexyl)-1,3-thiazol-2-amine has a molecular weight of 210.35 g/mol, XLogP of 3.52, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethylcyclohexyl)-1,3-thiazol-2-amine is sourced from PubChem (CID 60759773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).