N-(2-cyclohexylethyl)-1-ethyl-4-methylimidazol-2-amine

C14H25N3 — CID 106563379

IUPACN-(2-cyclohexylethyl)-1-ethyl-4-methylimidazol-2-amine
SMILESCCn1cc(C)nc1NCCC1CCCCC1
InChIInChI=1S/C14H25N3/c1-3-17-11-12(2)16-14(17)15-10-9-13-7-5-4-6-8-13/h11,13H,3-10H2,1-2H3,(H,15,16)
InChIKeyAJUNHLFPMAZXPY-UHFFFAOYSA-N
MW235.37 g/mol
LogP3.59
Rot. Bonds5

About N-(2-cyclohexylethyl)-1-ethyl-4-methylimidazol-2-amine

N-(2-cyclohexylethyl)-1-ethyl-4-methylimidazol-2-amine (PubChem CID 106563379) has the molecular formula C14H25N3 and a molecular weight of 235.37 g/mol. Its IUPAC name is N-(2-cyclohexylethyl)-1-ethyl-4-methylimidazol-2-amine.

Molecular Properties

Compound NameN-(2-cyclohexylethyl)-1-ethyl-4-methylimidazol-2-amine
PubChem CID106563379
Molecular FormulaC14H25N3
Molecular Weight235.37 g/mol
Exact Mass235.20
IUPAC NameN-(2-cyclohexylethyl)-1-ethyl-4-methylimidazol-2-amine
SMILESCCn1cc(C)nc1NCCC1CCCCC1
InChIInChI=1S/C14H25N3/c1-3-17-11-12(2)16-14(17)15-10-9-13-7-5-4-6-8-13/h11,13H,3-10H2,1-2H3,(H,15,16)
InChIKeyAJUNHLFPMAZXPY-UHFFFAOYSA-N
XLogP3.59
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.37
LogP ≤ 53.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

Methimepip
CID 11313837
4-((1H-imidazol-4-yl)methyl)-1-heptylpiperidine
CID 44406484
4-(cyclohexylmethyl)-1H-imidazole
CID 9793921
N-Cyclohexylmethyl-N''-[3-(1H-imidazol-4-yl)-propyl]-guanidine
CID 10332982
1-ethyl-4-(1H-imidazol-5-ylmethyl)piperidine
CID 11164099
3-[2-(1H-imidazol-5-yl)ethyl]piperidine
CID 11171320
4-(2-(1H-Imidazol-4-yl)ethyl)-1-ethylpiperidine
CID 11337639
4-[2-(1H-imidazol-5-yl)ethyl]-1-propan-2-ylpiperidine
CID 11474535
4-[2-(1H-imidazol-5-yl)ethyl]-1-methylpiperidine
CID 11739735
(1R,2S)-trans-2-[2-(cyclohexylmethylamino)ethyl]-1-(1H-imidazol-4-yl)cyclopropane
CID 16006947
(1R,2R)-trans-2-(cyclohexylmethylamino)methyl-1-(1H-imidazol-4yl)cyclopropane
CID 16082822
(1S,2S)-trans-2-(cyclohexylmethylamino)methyl-1-(1H-imidazol-4-yl)cyclopropane
CID 16082826

Frequently Asked Questions

What is the IUPAC name of N-(2-cyclohexylethyl)-1-ethyl-4-methylimidazol-2-amine?
The IUPAC name of N-(2-cyclohexylethyl)-1-ethyl-4-methylimidazol-2-amine (CID 106563379) is N-(2-cyclohexylethyl)-1-ethyl-4-methylimidazol-2-amine.
What is the SMILES notation for N-(2-cyclohexylethyl)-1-ethyl-4-methylimidazol-2-amine?
The canonical SMILES for N-(2-cyclohexylethyl)-1-ethyl-4-methylimidazol-2-amine is CCn1cc(C)nc1NCCC1CCCCC1.
What is the InChIKey of N-(2-cyclohexylethyl)-1-ethyl-4-methylimidazol-2-amine?
The InChIKey is AJUNHLFPMAZXPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3/c1-3-17-11-12(2)16-14(17)15-10-9-13-7-5-4-6-8-13/h11,13H,3-10H2,1-2H3,(H,15,16).
What are the key properties of N-(2-cyclohexylethyl)-1-ethyl-4-methylimidazol-2-amine?
N-(2-cyclohexylethyl)-1-ethyl-4-methylimidazol-2-amine has a molecular weight of 235.37 g/mol, XLogP of 3.59, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclohexylethyl)-1-ethyl-4-methylimidazol-2-amine is sourced from PubChem (CID 106563379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).