2H-indazol-3-ylmethanamine

C8H9N3 — CID 19431898

IUPAC2H-indazol-3-ylmethanamine
SMILESNCc1[nH]nc2ccccc12
InChIInChI=1S/C8H9N3/c9-5-8-6-3-1-2-4-7(6)10-11-8/h1-4H,5,9H2,(H,10,11)
InChIKeyGMIODCDIPHWWQY-UHFFFAOYSA-N
MW147.18 g/mol
LogP1.02
Rot. Bonds1

About 2H-indazol-3-ylmethanamine

2H-indazol-3-ylmethanamine (PubChem CID 19431898) has the molecular formula C8H9N3 and a molecular weight of 147.18 g/mol. Its IUPAC name is 2H-indazol-3-ylmethanamine.

Molecular Properties

Compound Name2H-indazol-3-ylmethanamine
PubChem CID19431898
Molecular FormulaC8H9N3
Molecular Weight147.18 g/mol
Exact Mass147.08
IUPAC Name2H-indazol-3-ylmethanamine
SMILESNCc1[nH]nc2ccccc12
InChIInChI=1S/C8H9N3/c9-5-8-6-3-1-2-4-7(6)10-11-8/h1-4H,5,9H2,(H,10,11)
InChIKeyGMIODCDIPHWWQY-UHFFFAOYSA-N
XLogP1.02
TPSA54.70 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.18
LogP ≤ 51.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2H-indazol-3-ylmethanamine?
The IUPAC name of 2H-indazol-3-ylmethanamine (CID 19431898) is 2H-indazol-3-ylmethanamine.
What is the SMILES notation for 2H-indazol-3-ylmethanamine?
The canonical SMILES for 2H-indazol-3-ylmethanamine is NCc1[nH]nc2ccccc12.
What is the InChIKey of 2H-indazol-3-ylmethanamine?
The InChIKey is GMIODCDIPHWWQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9N3/c9-5-8-6-3-1-2-4-7(6)10-11-8/h1-4H,5,9H2,(H,10,11).
What are the key properties of 2H-indazol-3-ylmethanamine?
2H-indazol-3-ylmethanamine has a molecular weight of 147.18 g/mol, XLogP of 1.02, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2H-indazol-3-ylmethanamine is sourced from PubChem (CID 19431898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).