5-(3,5-dimethylcyclohex-3-en-1-yl)-4,5-dihydro-1H-imidazol-2-amine

C11H19N3 — CID 103277924

IUPAC5-(3,5-dimethylcyclohex-3-en-1-yl)-4,5-dihydro-1H-imidazol-2-amine
SMILESCC1=CC(C)CC(C2CN=C(N)N2)C1
InChIInChI=1S/C11H19N3/c1-7-3-8(2)5-9(4-7)10-6-13-11(12)14-10/h3,7,9-10H,4-6H2,1-2H3,(H3,12,13,14)
InChIKeyKZRAVXVDMXJLTK-UHFFFAOYSA-N
MW193.29 g/mol
LogP1.27
Rot. Bonds1

About 5-(3,5-dimethylcyclohex-3-en-1-yl)-4,5-dihydro-1H-imidazol-2-amine

5-(3,5-dimethylcyclohex-3-en-1-yl)-4,5-dihydro-1H-imidazol-2-amine (PubChem CID 103277924) has the molecular formula C11H19N3 and a molecular weight of 193.29 g/mol. Its IUPAC name is 5-(3,5-dimethylcyclohex-3-en-1-yl)-4,5-dihydro-1H-imidazol-2-amine.

Molecular Properties

Compound Name5-(3,5-dimethylcyclohex-3-en-1-yl)-4,5-dihydro-1H-imidazol-2-amine
PubChem CID103277924
Molecular FormulaC11H19N3
Molecular Weight193.29 g/mol
Exact Mass193.16
IUPAC Name5-(3,5-dimethylcyclohex-3-en-1-yl)-4,5-dihydro-1H-imidazol-2-amine
SMILESCC1=CC(C)CC(C2CN=C(N)N2)C1
InChIInChI=1S/C11H19N3/c1-7-3-8(2)5-9(4-7)10-6-13-11(12)14-10/h3,7,9-10H,4-6H2,1-2H3,(H3,12,13,14)
InChIKeyKZRAVXVDMXJLTK-UHFFFAOYSA-N
XLogP1.27
TPSA50.41 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 51.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

5-[(4-methylcyclohex-2-en-1-yl)methyl]-4,5-dihydro-1H-imidazole
CID 66658868
5-[(3,5,5-trimethylcyclohex-2-en-1-yl)methyl]-4,5-dihydro-1H-imidazole
CID 66659577
5-[(3-methylcyclohex-2-en-1-yl)methyl]-4,5-dihydro-1H-imidazole
CID 68014673
5-[[(2R,4aS)-4a-methyl-3,4,5,6,7,8-hexahydro-2H-naphthalen-2-yl]methyl]-4,5-dihydro-1H-imidazole
CID 71083150
5-[(4a-methyl-3,4,5,6,7,8-hexahydro-2H-naphthalen-2-yl)methyl]-4,5-dihydro-1H-imidazole
CID 71083178
5-(cyclohex-3-en-1-ylmethyl)-4,5-dihydro-1H-imidazole
CID 89257746
Ethane;6-[(3-ethylcyclohex-2-en-1-yl)methyl]-1,4,5,6-tetrahydropyrimidine
CID 142171926
4,6,7-trimethyl-3a,4,7,7a-tetrahydro-1H-benzimidazole
CID 170440614
N-[2-(cyclohexen-1-yl)ethyl]-5-hexyl-4,5-dihydro-1H-imidazol-2-amine
CID 10946943
1-[2-(Cyclohexen-1-yl)ethyl]-2-(3,7-dimethyloct-6-enyl)guanidine
CID 10947846
[Amino-[2-(cyclohexen-1-yl)ethylamino]methylidene]-(3,7-dimethyloctyl)azanium chloride
CID 11727624
1-[2-(Cyclohexen-1-yl)ethyl]-2-(3,7-dimethyloctyl)guanidine
CID 11727625

Frequently Asked Questions

What is the IUPAC name of 5-(3,5-dimethylcyclohex-3-en-1-yl)-4,5-dihydro-1H-imidazol-2-amine?
The IUPAC name of 5-(3,5-dimethylcyclohex-3-en-1-yl)-4,5-dihydro-1H-imidazol-2-amine (CID 103277924) is 5-(3,5-dimethylcyclohex-3-en-1-yl)-4,5-dihydro-1H-imidazol-2-amine.
What is the SMILES notation for 5-(3,5-dimethylcyclohex-3-en-1-yl)-4,5-dihydro-1H-imidazol-2-amine?
The canonical SMILES for 5-(3,5-dimethylcyclohex-3-en-1-yl)-4,5-dihydro-1H-imidazol-2-amine is CC1=CC(C)CC(C2CN=C(N)N2)C1.
What is the InChIKey of 5-(3,5-dimethylcyclohex-3-en-1-yl)-4,5-dihydro-1H-imidazol-2-amine?
The InChIKey is KZRAVXVDMXJLTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3/c1-7-3-8(2)5-9(4-7)10-6-13-11(12)14-10/h3,7,9-10H,4-6H2,1-2H3,(H3,12,13,14).
What are the key properties of 5-(3,5-dimethylcyclohex-3-en-1-yl)-4,5-dihydro-1H-imidazol-2-amine?
5-(3,5-dimethylcyclohex-3-en-1-yl)-4,5-dihydro-1H-imidazol-2-amine has a molecular weight of 193.29 g/mol, XLogP of 1.27, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3,5-dimethylcyclohex-3-en-1-yl)-4,5-dihydro-1H-imidazol-2-amine is sourced from PubChem (CID 103277924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).