5-cyclohexyl-1-prop-2-enyl-4,5-dihydroimidazol-2-amine

C12H21N3 — CID 79497073

IUPAC5-cyclohexyl-1-prop-2-enyl-4,5-dihydroimidazol-2-amine
SMILESC=CCN1C(N)=NCC1C1CCCCC1
InChIInChI=1S/C12H21N3/c1-2-8-15-11(9-14-12(15)13)10-6-4-3-5-7-10/h2,10-11H,1,3-9H2,(H2,13,14)
InChIKeyBVFLHVDUSWVNJL-UHFFFAOYSA-N
MW207.32 g/mol
LogP1.75
Rot. Bonds3

About 5-cyclohexyl-1-prop-2-enyl-4,5-dihydroimidazol-2-amine

5-cyclohexyl-1-prop-2-enyl-4,5-dihydroimidazol-2-amine (PubChem CID 79497073) has the molecular formula C12H21N3 and a molecular weight of 207.32 g/mol. Its IUPAC name is 5-cyclohexyl-1-prop-2-enyl-4,5-dihydroimidazol-2-amine.

Molecular Properties

Compound Name5-cyclohexyl-1-prop-2-enyl-4,5-dihydroimidazol-2-amine
PubChem CID79497073
Molecular FormulaC12H21N3
Molecular Weight207.32 g/mol
Exact Mass207.17
IUPAC Name5-cyclohexyl-1-prop-2-enyl-4,5-dihydroimidazol-2-amine
SMILESC=CCN1C(N)=NCC1C1CCCCC1
InChIInChI=1S/C12H21N3/c1-2-8-15-11(9-14-12(15)13)10-6-4-3-5-7-10/h2,10-11H,1,3-9H2,(H2,13,14)
InChIKeyBVFLHVDUSWVNJL-UHFFFAOYSA-N
XLogP1.75
TPSA41.62 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.32
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

5-cyclopentyl-1-prop-2-enyl-4,5-dihydroimidazol-2-amine
CID 79496893
5-cycloheptyl-1-(2-methoxyethyl)-4,5-dihydroimidazol-2-amine
CID 79504714
5-amino-4-cycloheptyl-3-prop-2-enyl-4H-imidazol-2-one
CID 79966964
1-butan-2-yl-5-cyclooctyl-4,5-dihydroimidazol-2-amine
CID 114207983
5-(2-cyclopropylphenyl)-1-prop-2-enyl-4,5-dihydroimidazol-2-amine
CID 79982788
1-ethyl-5-(3-methylcyclohexyl)-4,5-dihydroimidazol-2-amine
CID 79509397
4-(2-amino-3-prop-2-enyl-4,5-dihydroimidazol-4-yl)phenol
CID 79498034
5-(1-methylpyrazol-4-yl)-1-prop-2-enyl-4,5-dihydroimidazol-2-amine
CID 79497687
5-(3-methylcyclohexyl)-1-propyl-4,5-dihydroimidazol-2-amine
CID 79509635
5-(2-fluorophenyl)-1-prop-2-enyl-4,5-dihydroimidazol-2-amine
CID 79496904
5-cycloheptyl-1-(4-fluorophenyl)-4,5-dihydroimidazol-2-amine
CID 79505667
5-(2,5-dimethylphenyl)-1-prop-2-enyl-4,5-dihydroimidazol-2-amine
CID 79497684

Frequently Asked Questions

What is the IUPAC name of 5-cyclohexyl-1-prop-2-enyl-4,5-dihydroimidazol-2-amine?
The IUPAC name of 5-cyclohexyl-1-prop-2-enyl-4,5-dihydroimidazol-2-amine (CID 79497073) is 5-cyclohexyl-1-prop-2-enyl-4,5-dihydroimidazol-2-amine.
What is the SMILES notation for 5-cyclohexyl-1-prop-2-enyl-4,5-dihydroimidazol-2-amine?
The canonical SMILES for 5-cyclohexyl-1-prop-2-enyl-4,5-dihydroimidazol-2-amine is C=CCN1C(N)=NCC1C1CCCCC1.
What is the InChIKey of 5-cyclohexyl-1-prop-2-enyl-4,5-dihydroimidazol-2-amine?
The InChIKey is BVFLHVDUSWVNJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3/c1-2-8-15-11(9-14-12(15)13)10-6-4-3-5-7-10/h2,10-11H,1,3-9H2,(H2,13,14).
What are the key properties of 5-cyclohexyl-1-prop-2-enyl-4,5-dihydroimidazol-2-amine?
5-cyclohexyl-1-prop-2-enyl-4,5-dihydroimidazol-2-amine has a molecular weight of 207.32 g/mol, XLogP of 1.75, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclohexyl-1-prop-2-enyl-4,5-dihydroimidazol-2-amine is sourced from PubChem (CID 79497073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).