1,4,5,6-tetrahydrocyclopenta[d]imidazol-2-amine

C6H9N3 — CID 39101052

IUPAC1,4,5,6-tetrahydrocyclopenta[d]imidazol-2-amine
SMILESNc1nc2c([nH]1)CCC2
InChIInChI=1S/C6H9N3/c7-6-8-4-2-1-3-5(4)9-6/h1-3H2,(H3,7,8,9)
InChIKeyUIGCVNXVDVSUTK-UHFFFAOYSA-N
MW123.16 g/mol
LogP0.48
Rot. Bonds

About 1,4,5,6-tetrahydrocyclopenta[d]imidazol-2-amine

1,4,5,6-tetrahydrocyclopenta[d]imidazol-2-amine (PubChem CID 39101052) has the molecular formula C6H9N3 and a molecular weight of 123.16 g/mol. Its IUPAC name is 1,4,5,6-tetrahydrocyclopenta[d]imidazol-2-amine.

Molecular Properties

Compound Name1,4,5,6-tetrahydrocyclopenta[d]imidazol-2-amine
PubChem CID39101052
Molecular FormulaC6H9N3
Molecular Weight123.16 g/mol
Exact Mass123.08
IUPAC Name1,4,5,6-tetrahydrocyclopenta[d]imidazol-2-amine
SMILESNc1nc2c([nH]1)CCC2
InChIInChI=1S/C6H9N3/c7-6-8-4-2-1-3-5(4)9-6/h1-3H2,(H3,7,8,9)
InChIKeyUIGCVNXVDVSUTK-UHFFFAOYSA-N
XLogP0.48
TPSA54.70 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500123.16
LogP ≤ 50.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 1,4,5,6-tetrahydrocyclopenta[d]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

Related Compounds

1,4,5,6,7,8-hexahydrocyclohepta[d]imidazol-2-amine
CID 66201526
6,6-difluoro-1,4,5,7-tetrahydrobenzimidazol-2-amine
CID 167714971
4,5,6,7-tetrahydro-1H-benzimidazol-2-ylmethanamine;dihydrochloride
CID 71779243
2-amino-1-(1,4,5,6-tetrahydrocyclopenta[d]imidazol-2-yl)ethanol
CID 84731706
2-(azetidin-3-yl)-1,4,5,6-tetrahydrocyclopenta[d]imidazole
CID 115012866
5-ethyl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridin-2-amine
CID 66202304
N-methyl-1-(1,4,5,6-tetrahydrocyclopenta[d]imidazol-2-yl)methanamine
CID 63927396
2-phenyl-1,4,5,6-tetrahydrocyclopenta[d]imidazole
CID 141264099
4,5,6,7-tetrahydro-1H-benzimidazole-2-carbaldehyde
CID 63926594
2-piperidin-4-yl-1,4,5,6-tetrahydrocyclopenta[d]imidazole
CID 82463423
2-amino-3,6,7,8-tetrahydrothiopyrano[3,2-d]pyrimidin-4-one
CID 135841625
2-(4,5,6,7-tetrahydro-1H-benzimidazol-2-yl)butan-2-amine
CID 102970045

Frequently Asked Questions

What is the IUPAC name of 1,4,5,6-tetrahydrocyclopenta[d]imidazol-2-amine?
The IUPAC name of 1,4,5,6-tetrahydrocyclopenta[d]imidazol-2-amine (CID 39101052) is 1,4,5,6-tetrahydrocyclopenta[d]imidazol-2-amine.
What is the SMILES notation for 1,4,5,6-tetrahydrocyclopenta[d]imidazol-2-amine?
The canonical SMILES for 1,4,5,6-tetrahydrocyclopenta[d]imidazol-2-amine is Nc1nc2c([nH]1)CCC2.
What is the InChIKey of 1,4,5,6-tetrahydrocyclopenta[d]imidazol-2-amine?
The InChIKey is UIGCVNXVDVSUTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9N3/c7-6-8-4-2-1-3-5(4)9-6/h1-3H2,(H3,7,8,9).
What are the key properties of 1,4,5,6-tetrahydrocyclopenta[d]imidazol-2-amine?
1,4,5,6-tetrahydrocyclopenta[d]imidazol-2-amine has a molecular weight of 123.16 g/mol, XLogP of 0.48, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4,5,6-tetrahydrocyclopenta[d]imidazol-2-amine is sourced from PubChem (CID 39101052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).