1-cycloheptyl-5-cyclopropyl-5-ethyl-4H-imidazol-2-amine

C15H27N3 — CID 79498255

IUPAC1-cycloheptyl-5-cyclopropyl-5-ethyl-4H-imidazol-2-amine
SMILESCCC1(C2CC2)CN=C(N)N1C1CCCCCC1
InChIInChI=1S/C15H27N3/c1-2-15(12-9-10-12)11-17-14(16)18(15)13-7-5-3-4-6-8-13/h12-13H,2-11H2,1H3,(H2,16,17)
InChIKeyKKOMGTYPVYUIAO-UHFFFAOYSA-N
MW249.40 g/mol
LogP2.90
Rot. Bonds3

About 1-cycloheptyl-5-cyclopropyl-5-ethyl-4H-imidazol-2-amine

1-cycloheptyl-5-cyclopropyl-5-ethyl-4H-imidazol-2-amine (PubChem CID 79498255) has the molecular formula C15H27N3 and a molecular weight of 249.40 g/mol. Its IUPAC name is 1-cycloheptyl-5-cyclopropyl-5-ethyl-4H-imidazol-2-amine.

Molecular Properties

Compound Name1-cycloheptyl-5-cyclopropyl-5-ethyl-4H-imidazol-2-amine
PubChem CID79498255
Molecular FormulaC15H27N3
Molecular Weight249.40 g/mol
Exact Mass249.22
IUPAC Name1-cycloheptyl-5-cyclopropyl-5-ethyl-4H-imidazol-2-amine
SMILESCCC1(C2CC2)CN=C(N)N1C1CCCCCC1
InChIInChI=1S/C15H27N3/c1-2-15(12-9-10-12)11-17-14(16)18(15)13-7-5-3-4-6-8-13/h12-13H,2-11H2,1H3,(H2,16,17)
InChIKeyKKOMGTYPVYUIAO-UHFFFAOYSA-N
XLogP2.90
TPSA41.62 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.40
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-cycloheptyl-5-cyclopropyl-5-ethyl-4H-imidazol-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-cycloheptyl-5-cyclopropyl-5-ethyl-4H-imidazol-2-amine?
The IUPAC name of 1-cycloheptyl-5-cyclopropyl-5-ethyl-4H-imidazol-2-amine (CID 79498255) is 1-cycloheptyl-5-cyclopropyl-5-ethyl-4H-imidazol-2-amine.
What is the SMILES notation for 1-cycloheptyl-5-cyclopropyl-5-ethyl-4H-imidazol-2-amine?
The canonical SMILES for 1-cycloheptyl-5-cyclopropyl-5-ethyl-4H-imidazol-2-amine is CCC1(C2CC2)CN=C(N)N1C1CCCCCC1.
What is the InChIKey of 1-cycloheptyl-5-cyclopropyl-5-ethyl-4H-imidazol-2-amine?
The InChIKey is KKOMGTYPVYUIAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N3/c1-2-15(12-9-10-12)11-17-14(16)18(15)13-7-5-3-4-6-8-13/h12-13H,2-11H2,1H3,(H2,16,17).
What are the key properties of 1-cycloheptyl-5-cyclopropyl-5-ethyl-4H-imidazol-2-amine?
1-cycloheptyl-5-cyclopropyl-5-ethyl-4H-imidazol-2-amine has a molecular weight of 249.40 g/mol, XLogP of 2.90, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cycloheptyl-5-cyclopropyl-5-ethyl-4H-imidazol-2-amine is sourced from PubChem (CID 79498255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).