2,3-dihydro-1H-indazol-6-amine

C7H9N3 — CID 66759911

IUPAC2,3-dihydro-1H-indazol-6-amine
SMILESNc1ccc2c(c1)NNC2
InChIInChI=1S/C7H9N3/c8-6-2-1-5-4-9-10-7(5)3-6/h1-3,9-10H,4,8H2
InChIKeyZCGRNJHLHKFIFI-UHFFFAOYSA-N
MW135.17 g/mol
LogP0.70
Rot. Bonds

About 2,3-dihydro-1H-indazol-6-amine

2,3-dihydro-1H-indazol-6-amine (PubChem CID 66759911) has the molecular formula C7H9N3 and a molecular weight of 135.17 g/mol. Its IUPAC name is 2,3-dihydro-1H-indazol-6-amine.

Molecular Properties

Compound Name2,3-dihydro-1H-indazol-6-amine
PubChem CID66759911
Molecular FormulaC7H9N3
Molecular Weight135.17 g/mol
Exact Mass135.08
IUPAC Name2,3-dihydro-1H-indazol-6-amine
SMILESNc1ccc2c(c1)NNC2
InChIInChI=1S/C7H9N3/c8-6-2-1-5-4-9-10-7(5)3-6/h1-3,9-10H,4,8H2
InChIKeyZCGRNJHLHKFIFI-UHFFFAOYSA-N
XLogP0.70
TPSA50.08 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500135.17
LogP ≤ 50.70
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2,3-dihydro-1H-indazol-6-amine?
The IUPAC name of 2,3-dihydro-1H-indazol-6-amine (CID 66759911) is 2,3-dihydro-1H-indazol-6-amine.
What is the SMILES notation for 2,3-dihydro-1H-indazol-6-amine?
The canonical SMILES for 2,3-dihydro-1H-indazol-6-amine is Nc1ccc2c(c1)NNC2.
What is the InChIKey of 2,3-dihydro-1H-indazol-6-amine?
The InChIKey is ZCGRNJHLHKFIFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9N3/c8-6-2-1-5-4-9-10-7(5)3-6/h1-3,9-10H,4,8H2.
What are the key properties of 2,3-dihydro-1H-indazol-6-amine?
2,3-dihydro-1H-indazol-6-amine has a molecular weight of 135.17 g/mol, XLogP of 0.70, 0 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydro-1H-indazol-6-amine is sourced from PubChem (CID 66759911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).