3,5-dihydrocyclopenta[f]benzimidazol-2-amine

C10H9N3 — CID 118526229

IUPAC3,5-dihydrocyclopenta[f]benzimidazol-2-amine
SMILESNc1nc2cc3c(cc2[nH]1)CC=C3
InChIInChI=1S/C10H9N3/c11-10-12-8-4-6-2-1-3-7(6)5-9(8)13-10/h1-2,4-5H,3H2,(H3,11,12,13)
InChIKeyKSGYHTTVZVHTQW-UHFFFAOYSA-N
MW171.20 g/mol
LogP1.71
Rot. Bonds

About 3,5-dihydrocyclopenta[f]benzimidazol-2-amine

3,5-dihydrocyclopenta[f]benzimidazol-2-amine (PubChem CID 118526229) has the molecular formula C10H9N3 and a molecular weight of 171.20 g/mol. Its IUPAC name is 3,5-dihydrocyclopenta[f]benzimidazol-2-amine.

Molecular Properties

Compound Name3,5-dihydrocyclopenta[f]benzimidazol-2-amine
PubChem CID118526229
Molecular FormulaC10H9N3
Molecular Weight171.20 g/mol
Exact Mass171.08
IUPAC Name3,5-dihydrocyclopenta[f]benzimidazol-2-amine
SMILESNc1nc2cc3c(cc2[nH]1)CC=C3
InChIInChI=1S/C10H9N3/c11-10-12-8-4-6-2-1-3-7(6)5-9(8)13-10/h1-2,4-5H,3H2,(H3,11,12,13)
InChIKeyKSGYHTTVZVHTQW-UHFFFAOYSA-N
XLogP1.71
TPSA54.70 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.20
LogP ≤ 51.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3,5-dihydrocyclopenta[f]benzimidazol-2-amine?
The IUPAC name of 3,5-dihydrocyclopenta[f]benzimidazol-2-amine (CID 118526229) is 3,5-dihydrocyclopenta[f]benzimidazol-2-amine.
What is the SMILES notation for 3,5-dihydrocyclopenta[f]benzimidazol-2-amine?
The canonical SMILES for 3,5-dihydrocyclopenta[f]benzimidazol-2-amine is Nc1nc2cc3c(cc2[nH]1)CC=C3.
What is the InChIKey of 3,5-dihydrocyclopenta[f]benzimidazol-2-amine?
The InChIKey is KSGYHTTVZVHTQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9N3/c11-10-12-8-4-6-2-1-3-7(6)5-9(8)13-10/h1-2,4-5H,3H2,(H3,11,12,13).
What are the key properties of 3,5-dihydrocyclopenta[f]benzimidazol-2-amine?
3,5-dihydrocyclopenta[f]benzimidazol-2-amine has a molecular weight of 171.20 g/mol, XLogP of 1.71, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dihydrocyclopenta[f]benzimidazol-2-amine is sourced from PubChem (CID 118526229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).