N-ethyl-2-(1H-imidazol-2-yl)-1-(1-methylcyclohexyl)ethanamine

C14H25N3 — CID 106826923

IUPACN-ethyl-2-(1H-imidazol-2-yl)-1-(1-methylcyclohexyl)ethanamine
SMILESCCNC(Cc1ncc[nH]1)C1(C)CCCCC1
InChIInChI=1S/C14H25N3/c1-3-15-12(11-13-16-9-10-17-13)14(2)7-5-4-6-8-14/h9-10,12,15H,3-8,11H2,1-2H3,(H,16,17)
InChIKeyLMNXHUGOTALLDQ-UHFFFAOYSA-N
MW235.37 g/mol
LogP2.90
Rot. Bonds5

About N-ethyl-2-(1H-imidazol-2-yl)-1-(1-methylcyclohexyl)ethanamine

N-ethyl-2-(1H-imidazol-2-yl)-1-(1-methylcyclohexyl)ethanamine (PubChem CID 106826923) has the molecular formula C14H25N3 and a molecular weight of 235.37 g/mol. Its IUPAC name is N-ethyl-2-(1H-imidazol-2-yl)-1-(1-methylcyclohexyl)ethanamine.

Molecular Properties

Compound NameN-ethyl-2-(1H-imidazol-2-yl)-1-(1-methylcyclohexyl)ethanamine
PubChem CID106826923
Molecular FormulaC14H25N3
Molecular Weight235.37 g/mol
Exact Mass235.20
IUPAC NameN-ethyl-2-(1H-imidazol-2-yl)-1-(1-methylcyclohexyl)ethanamine
SMILESCCNC(Cc1ncc[nH]1)C1(C)CCCCC1
InChIInChI=1S/C14H25N3/c1-3-15-12(11-13-16-9-10-17-13)14(2)7-5-4-6-8-14/h9-10,12,15H,3-8,11H2,1-2H3,(H,16,17)
InChIKeyLMNXHUGOTALLDQ-UHFFFAOYSA-N
XLogP2.90
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.37
LogP ≤ 52.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(1H-imidazol-2-yl)-1-(1-methylcyclohexyl)ethanol
CID 106828317
N-ethyl-1-(1H-imidazol-2-yl)-3-methylbutan-2-amine
CID 43493340
2-(3,4-dichlorophenyl)-N-ethyl-1-(1-methylcyclohexyl)ethanamine
CID 106827647
2-(4-bromo-3-ethyl-1-methylpyrazol-5-yl)-N-ethyl-1-(1-methylcyclohexyl)ethanamine
CID 106830227
N-ethyl-1-(1-methylcyclopentyl)-2-quinolin-4-ylethanamine
CID 104997457
N-ethyl-1-(1H-imidazol-2-yl)octan-2-amine
CID 114752420
bis(2-ethyl-1H-imidazole);hydrate
CID 70001211
2-ethyl-1H-imidazole;dihydroiodide
CID 175121589
2-(4-chloro-3-fluorophenyl)-N-ethyl-1-(1-methylcyclohexyl)ethanamine
CID 107891871
2-[2-bromo-2-(2,2-dimethylcyclopentyl)ethyl]-1H-imidazole
CID 107182298
1-(2,6-dichlorophenyl)-N-ethyl-2-(1H-imidazol-2-yl)ethanamine
CID 43493442
2-(2,3-dichlorophenyl)-N-ethyl-1-(1-methylcyclopentyl)ethanamine
CID 107312340

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-(1H-imidazol-2-yl)-1-(1-methylcyclohexyl)ethanamine?
The IUPAC name of N-ethyl-2-(1H-imidazol-2-yl)-1-(1-methylcyclohexyl)ethanamine (CID 106826923) is N-ethyl-2-(1H-imidazol-2-yl)-1-(1-methylcyclohexyl)ethanamine.
What is the SMILES notation for N-ethyl-2-(1H-imidazol-2-yl)-1-(1-methylcyclohexyl)ethanamine?
The canonical SMILES for N-ethyl-2-(1H-imidazol-2-yl)-1-(1-methylcyclohexyl)ethanamine is CCNC(Cc1ncc[nH]1)C1(C)CCCCC1.
What is the InChIKey of N-ethyl-2-(1H-imidazol-2-yl)-1-(1-methylcyclohexyl)ethanamine?
The InChIKey is LMNXHUGOTALLDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3/c1-3-15-12(11-13-16-9-10-17-13)14(2)7-5-4-6-8-14/h9-10,12,15H,3-8,11H2,1-2H3,(H,16,17).
What are the key properties of N-ethyl-2-(1H-imidazol-2-yl)-1-(1-methylcyclohexyl)ethanamine?
N-ethyl-2-(1H-imidazol-2-yl)-1-(1-methylcyclohexyl)ethanamine has a molecular weight of 235.37 g/mol, XLogP of 2.90, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-(1H-imidazol-2-yl)-1-(1-methylcyclohexyl)ethanamine is sourced from PubChem (CID 106826923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).