2,5-dihydro-1H-cyclopenta[d]pyridazin-4-amine

C7H9N3 — CID 166010827

IUPAC2,5-dihydro-1H-cyclopenta[d]pyridazin-4-amine
SMILESNC1=NNCC2=C1CC=C2
InChIInChI=1S/C7H9N3/c8-7-6-3-1-2-5(6)4-9-10-7/h1-2,9H,3-4H2,(H2,8,10)
InChIKeyUKRKQNHXUIXBFF-UHFFFAOYSA-N
MW135.17 g/mol
LogP0.12
Rot. Bonds

About 2,5-dihydro-1H-cyclopenta[d]pyridazin-4-amine

2,5-dihydro-1H-cyclopenta[d]pyridazin-4-amine (PubChem CID 166010827) has the molecular formula C7H9N3 and a molecular weight of 135.17 g/mol. Its IUPAC name is 2,5-dihydro-1H-cyclopenta[d]pyridazin-4-amine.

Molecular Properties

Compound Name2,5-dihydro-1H-cyclopenta[d]pyridazin-4-amine
PubChem CID166010827
Molecular FormulaC7H9N3
Molecular Weight135.17 g/mol
Exact Mass135.08
IUPAC Name2,5-dihydro-1H-cyclopenta[d]pyridazin-4-amine
SMILESNC1=NNCC2=C1CC=C2
InChIInChI=1S/C7H9N3/c8-7-6-3-1-2-5(6)4-9-10-7/h1-2,9H,3-4H2,(H2,8,10)
InChIKeyUKRKQNHXUIXBFF-UHFFFAOYSA-N
XLogP0.12
TPSA50.41 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500135.17
LogP ≤ 50.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,5-dihydro-1H-cyclopenta[d]pyridazin-4-amine?
The IUPAC name of 2,5-dihydro-1H-cyclopenta[d]pyridazin-4-amine (CID 166010827) is 2,5-dihydro-1H-cyclopenta[d]pyridazin-4-amine.
What is the SMILES notation for 2,5-dihydro-1H-cyclopenta[d]pyridazin-4-amine?
The canonical SMILES for 2,5-dihydro-1H-cyclopenta[d]pyridazin-4-amine is NC1=NNCC2=C1CC=C2.
What is the InChIKey of 2,5-dihydro-1H-cyclopenta[d]pyridazin-4-amine?
The InChIKey is UKRKQNHXUIXBFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9N3/c8-7-6-3-1-2-5(6)4-9-10-7/h1-2,9H,3-4H2,(H2,8,10).
What are the key properties of 2,5-dihydro-1H-cyclopenta[d]pyridazin-4-amine?
2,5-dihydro-1H-cyclopenta[d]pyridazin-4-amine has a molecular weight of 135.17 g/mol, XLogP of 0.12, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dihydro-1H-cyclopenta[d]pyridazin-4-amine is sourced from PubChem (CID 166010827), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).