5-ethyl-2,3,5,6,7,7a-hexahydro-1H-imidazo[1,5-c]imidazole

C7H15N3 — CID 67975746

IUPAC5-ethyl-2,3,5,6,7,7a-hexahydro-1H-imidazo[1,5-c]imidazole
SMILESCCC1NCC2CNCN21
InChIInChI=1S/C7H15N3/c1-2-7-9-4-6-3-8-5-10(6)7/h6-9H,2-5H2,1H3
InChIKeyGOWILAVFLPRDMU-UHFFFAOYSA-N
MW141.22 g/mol
LogP-0.44
Rot. Bonds1

About 5-ethyl-2,3,5,6,7,7a-hexahydro-1H-imidazo[1,5-c]imidazole

5-ethyl-2,3,5,6,7,7a-hexahydro-1H-imidazo[1,5-c]imidazole (PubChem CID 67975746) has the molecular formula C7H15N3 and a molecular weight of 141.22 g/mol. Its IUPAC name is 5-ethyl-2,3,5,6,7,7a-hexahydro-1H-imidazo[1,5-c]imidazole.

Molecular Properties

Compound Name5-ethyl-2,3,5,6,7,7a-hexahydro-1H-imidazo[1,5-c]imidazole
PubChem CID67975746
Molecular FormulaC7H15N3
Molecular Weight141.22 g/mol
Exact Mass141.13
IUPAC Name5-ethyl-2,3,5,6,7,7a-hexahydro-1H-imidazo[1,5-c]imidazole
SMILESCCC1NCC2CNCN21
InChIInChI=1S/C7H15N3/c1-2-7-9-4-6-3-8-5-10(6)7/h6-9H,2-5H2,1H3
InChIKeyGOWILAVFLPRDMU-UHFFFAOYSA-N
XLogP-0.44
TPSA27.30 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.22
LogP ≤ 5-0.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 5-ethyl-2,3,5,6,7,7a-hexahydro-1H-imidazo[1,5-c]imidazole 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 5-ethyl-2,3,5,6,7,7a-hexahydro-1H-imidazo[1,5-c]imidazole?
The IUPAC name of 5-ethyl-2,3,5,6,7,7a-hexahydro-1H-imidazo[1,5-c]imidazole (CID 67975746) is 5-ethyl-2,3,5,6,7,7a-hexahydro-1H-imidazo[1,5-c]imidazole.
What is the SMILES notation for 5-ethyl-2,3,5,6,7,7a-hexahydro-1H-imidazo[1,5-c]imidazole?
The canonical SMILES for 5-ethyl-2,3,5,6,7,7a-hexahydro-1H-imidazo[1,5-c]imidazole is CCC1NCC2CNCN21.
What is the InChIKey of 5-ethyl-2,3,5,6,7,7a-hexahydro-1H-imidazo[1,5-c]imidazole?
The InChIKey is GOWILAVFLPRDMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15N3/c1-2-7-9-4-6-3-8-5-10(6)7/h6-9H,2-5H2,1H3.
What are the key properties of 5-ethyl-2,3,5,6,7,7a-hexahydro-1H-imidazo[1,5-c]imidazole?
5-ethyl-2,3,5,6,7,7a-hexahydro-1H-imidazo[1,5-c]imidazole has a molecular weight of 141.22 g/mol, XLogP of -0.44, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-2,3,5,6,7,7a-hexahydro-1H-imidazo[1,5-c]imidazole is sourced from PubChem (CID 67975746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).