N-phenylindazol-2-amine

C13H11N3 — CID 13143691

IUPACN-phenylindazol-2-amine
SMILESc1ccc(Nn2cc3ccccc3n2)cc1
InChIInChI=1S/C13H11N3/c1-2-7-12(8-3-1)14-16-10-11-6-4-5-9-13(11)15-16/h1-10,14H
InChIKeyFBQMCWNJSPXKIK-UHFFFAOYSA-N
MW209.25 g/mol
LogP2.91
Rot. Bonds2

About N-phenylindazol-2-amine

N-phenylindazol-2-amine (PubChem CID 13143691) has the molecular formula C13H11N3 and a molecular weight of 209.25 g/mol. Its IUPAC name is N-phenylindazol-2-amine.

Molecular Properties

Compound NameN-phenylindazol-2-amine
PubChem CID13143691
Molecular FormulaC13H11N3
Molecular Weight209.25 g/mol
Exact Mass209.10
IUPAC NameN-phenylindazol-2-amine
SMILESc1ccc(Nn2cc3ccccc3n2)cc1
InChIInChI=1S/C13H11N3/c1-2-7-12(8-3-1)14-16-10-11-6-4-5-9-13(11)15-16/h1-10,14H
InChIKeyFBQMCWNJSPXKIK-UHFFFAOYSA-N
XLogP2.91
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.25
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-phenylindazol-2-amine?
The IUPAC name of N-phenylindazol-2-amine (CID 13143691) is N-phenylindazol-2-amine.
What is the SMILES notation for N-phenylindazol-2-amine?
The canonical SMILES for N-phenylindazol-2-amine is c1ccc(Nn2cc3ccccc3n2)cc1.
What is the InChIKey of N-phenylindazol-2-amine?
The InChIKey is FBQMCWNJSPXKIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11N3/c1-2-7-12(8-3-1)14-16-10-11-6-4-5-9-13(11)15-16/h1-10,14H.
What are the key properties of N-phenylindazol-2-amine?
N-phenylindazol-2-amine has a molecular weight of 209.25 g/mol, XLogP of 2.91, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-phenylindazol-2-amine is sourced from PubChem (CID 13143691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).