6-bromo-2-[(2-fluorophenyl)methyl]indazol-3-amine

C14H11BrFN3 — CID 58529659

IUPAC6-bromo-2-[(2-fluorophenyl)methyl]indazol-3-amine
SMILESNc1c2ccc(Br)cc2nn1Cc1ccccc1F
InChIInChI=1S/C14H11BrFN3/c15-10-5-6-11-13(7-10)18-19(14(11)17)8-9-3-1-2-4-12(9)16/h1-7H,8,17H2
InChIKeyRRVIZNQTQHSWMW-UHFFFAOYSA-N
MW320.17 g/mol
LogP3.57
Rot. Bonds2

About 6-bromo-2-[(2-fluorophenyl)methyl]indazol-3-amine

6-bromo-2-[(2-fluorophenyl)methyl]indazol-3-amine (PubChem CID 58529659) has the molecular formula C14H11BrFN3 and a molecular weight of 320.17 g/mol. Its IUPAC name is 6-bromo-2-[(2-fluorophenyl)methyl]indazol-3-amine.

Molecular Properties

Compound Name6-bromo-2-[(2-fluorophenyl)methyl]indazol-3-amine
PubChem CID58529659
Molecular FormulaC14H11BrFN3
Molecular Weight320.17 g/mol
Exact Mass319.01
IUPAC Name6-bromo-2-[(2-fluorophenyl)methyl]indazol-3-amine
SMILESNc1c2ccc(Br)cc2nn1Cc1ccccc1F
InChIInChI=1S/C14H11BrFN3/c15-10-5-6-11-13(7-10)18-19(14(11)17)8-9-3-1-2-4-12(9)16/h1-7H,8,17H2
InChIKeyRRVIZNQTQHSWMW-UHFFFAOYSA-N
XLogP3.57
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.17
LogP ≤ 53.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-bromo-2-[(2-fluorophenyl)methyl]indazol-3-amine?
The IUPAC name of 6-bromo-2-[(2-fluorophenyl)methyl]indazol-3-amine (CID 58529659) is 6-bromo-2-[(2-fluorophenyl)methyl]indazol-3-amine.
What is the SMILES notation for 6-bromo-2-[(2-fluorophenyl)methyl]indazol-3-amine?
The canonical SMILES for 6-bromo-2-[(2-fluorophenyl)methyl]indazol-3-amine is Nc1c2ccc(Br)cc2nn1Cc1ccccc1F.
What is the InChIKey of 6-bromo-2-[(2-fluorophenyl)methyl]indazol-3-amine?
The InChIKey is RRVIZNQTQHSWMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11BrFN3/c15-10-5-6-11-13(7-10)18-19(14(11)17)8-9-3-1-2-4-12(9)16/h1-7H,8,17H2.
What are the key properties of 6-bromo-2-[(2-fluorophenyl)methyl]indazol-3-amine?
6-bromo-2-[(2-fluorophenyl)methyl]indazol-3-amine has a molecular weight of 320.17 g/mol, XLogP of 3.57, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-2-[(2-fluorophenyl)methyl]indazol-3-amine is sourced from PubChem (CID 58529659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).