5-cyclohex-3-en-1-yl-1-ethyl-4,5-dihydroimidazol-2-amine

C11H19N3 — CID 79509489

IUPAC5-cyclohex-3-en-1-yl-1-ethyl-4,5-dihydroimidazol-2-amine
SMILESCCN1C(N)=NCC1C1CC=CCC1
InChIInChI=1S/C11H19N3/c1-2-14-10(8-13-11(14)12)9-6-4-3-5-7-9/h3-4,9-10H,2,5-8H2,1H3,(H2,12,13)
InChIKeyGSMFOTCKLCHDFO-UHFFFAOYSA-N
MW193.29 g/mol
LogP1.36
Rot. Bonds2

About 5-cyclohex-3-en-1-yl-1-ethyl-4,5-dihydroimidazol-2-amine

5-cyclohex-3-en-1-yl-1-ethyl-4,5-dihydroimidazol-2-amine (PubChem CID 79509489) has the molecular formula C11H19N3 and a molecular weight of 193.29 g/mol. Its IUPAC name is 5-cyclohex-3-en-1-yl-1-ethyl-4,5-dihydroimidazol-2-amine.

Molecular Properties

Compound Name5-cyclohex-3-en-1-yl-1-ethyl-4,5-dihydroimidazol-2-amine
PubChem CID79509489
Molecular FormulaC11H19N3
Molecular Weight193.29 g/mol
Exact Mass193.16
IUPAC Name5-cyclohex-3-en-1-yl-1-ethyl-4,5-dihydroimidazol-2-amine
SMILESCCN1C(N)=NCC1C1CC=CCC1
InChIInChI=1S/C11H19N3/c1-2-14-10(8-13-11(14)12)9-6-4-3-5-7-9/h3-4,9-10H,2,5-8H2,1H3,(H2,12,13)
InChIKeyGSMFOTCKLCHDFO-UHFFFAOYSA-N
XLogP1.36
TPSA41.62 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 51.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 5-cyclohex-3-en-1-yl-1-ethyl-4,5-dihydroimidazol-2-amine?
The IUPAC name of 5-cyclohex-3-en-1-yl-1-ethyl-4,5-dihydroimidazol-2-amine (CID 79509489) is 5-cyclohex-3-en-1-yl-1-ethyl-4,5-dihydroimidazol-2-amine.
What is the SMILES notation for 5-cyclohex-3-en-1-yl-1-ethyl-4,5-dihydroimidazol-2-amine?
The canonical SMILES for 5-cyclohex-3-en-1-yl-1-ethyl-4,5-dihydroimidazol-2-amine is CCN1C(N)=NCC1C1CC=CCC1.
What is the InChIKey of 5-cyclohex-3-en-1-yl-1-ethyl-4,5-dihydroimidazol-2-amine?
The InChIKey is GSMFOTCKLCHDFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3/c1-2-14-10(8-13-11(14)12)9-6-4-3-5-7-9/h3-4,9-10H,2,5-8H2,1H3,(H2,12,13).
What are the key properties of 5-cyclohex-3-en-1-yl-1-ethyl-4,5-dihydroimidazol-2-amine?
5-cyclohex-3-en-1-yl-1-ethyl-4,5-dihydroimidazol-2-amine has a molecular weight of 193.29 g/mol, XLogP of 1.36, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclohex-3-en-1-yl-1-ethyl-4,5-dihydroimidazol-2-amine is sourced from PubChem (CID 79509489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).