5-propan-2-yl-1,4,5,6-tetrahydrocyclopenta[d]imidazole

C9H14N2 — CID 59096628

IUPAC5-propan-2-yl-1,4,5,6-tetrahydrocyclopenta[d]imidazole
SMILESCC(C)C1Cc2nc[nH]c2C1
InChIInChI=1S/C9H14N2/c1-6(2)7-3-8-9(4-7)11-5-10-8/h5-7H,3-4H2,1-2H3,(H,10,11)
InChIKeyXDHNNCKHJNWELM-UHFFFAOYSA-N
MW150.22 g/mol
LogP1.78
Rot. Bonds1

About 5-propan-2-yl-1,4,5,6-tetrahydrocyclopenta[d]imidazole

5-propan-2-yl-1,4,5,6-tetrahydrocyclopenta[d]imidazole (PubChem CID 59096628) has the molecular formula C9H14N2 and a molecular weight of 150.22 g/mol. Its IUPAC name is 5-propan-2-yl-1,4,5,6-tetrahydrocyclopenta[d]imidazole.

Molecular Properties

Compound Name5-propan-2-yl-1,4,5,6-tetrahydrocyclopenta[d]imidazole
PubChem CID59096628
Molecular FormulaC9H14N2
Molecular Weight150.22 g/mol
Exact Mass150.12
IUPAC Name5-propan-2-yl-1,4,5,6-tetrahydrocyclopenta[d]imidazole
SMILESCC(C)C1Cc2nc[nH]c2C1
InChIInChI=1S/C9H14N2/c1-6(2)7-3-8-9(4-7)11-5-10-8/h5-7H,3-4H2,1-2H3,(H,10,11)
InChIKeyXDHNNCKHJNWELM-UHFFFAOYSA-N
XLogP1.78
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.22
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 5-propan-2-yl-1,4,5,6-tetrahydrocyclopenta[d]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-propan-2-yl-1,4,5,6-tetrahydrocyclopenta[d]imidazole?
The IUPAC name of 5-propan-2-yl-1,4,5,6-tetrahydrocyclopenta[d]imidazole (CID 59096628) is 5-propan-2-yl-1,4,5,6-tetrahydrocyclopenta[d]imidazole.
What is the SMILES notation for 5-propan-2-yl-1,4,5,6-tetrahydrocyclopenta[d]imidazole?
The canonical SMILES for 5-propan-2-yl-1,4,5,6-tetrahydrocyclopenta[d]imidazole is CC(C)C1Cc2nc[nH]c2C1.
What is the InChIKey of 5-propan-2-yl-1,4,5,6-tetrahydrocyclopenta[d]imidazole?
The InChIKey is XDHNNCKHJNWELM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2/c1-6(2)7-3-8-9(4-7)11-5-10-8/h5-7H,3-4H2,1-2H3,(H,10,11).
What are the key properties of 5-propan-2-yl-1,4,5,6-tetrahydrocyclopenta[d]imidazole?
5-propan-2-yl-1,4,5,6-tetrahydrocyclopenta[d]imidazole has a molecular weight of 150.22 g/mol, XLogP of 1.78, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-propan-2-yl-1,4,5,6-tetrahydrocyclopenta[d]imidazole is sourced from PubChem (CID 59096628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).