5-bromo-N-(4-chloro-2-fluorophenyl)-1H-indazol-3-amine

C13H8BrClFN3 — CID 143548220

IUPAC5-bromo-N-(4-chloro-2-fluorophenyl)-1H-indazol-3-amine
SMILESFc1cc(Cl)ccc1Nc1n[nH]c2ccc(Br)cc12
InChIInChI=1S/C13H8BrClFN3/c14-7-1-3-11-9(5-7)13(19-18-11)17-12-4-2-8(15)6-10(12)16/h1-6H,(H2,17,18,19)
InChIKeyLAUPFEFJZWRXER-UHFFFAOYSA-N
MW340.58 g/mol
LogP4.86
Rot. Bonds2

About 5-bromo-N-(4-chloro-2-fluorophenyl)-1H-indazol-3-amine

5-bromo-N-(4-chloro-2-fluorophenyl)-1H-indazol-3-amine (PubChem CID 143548220) has the molecular formula C13H8BrClFN3 and a molecular weight of 340.58 g/mol. Its IUPAC name is 5-bromo-N-(4-chloro-2-fluorophenyl)-1H-indazol-3-amine.

Molecular Properties

Compound Name5-bromo-N-(4-chloro-2-fluorophenyl)-1H-indazol-3-amine
PubChem CID143548220
Molecular FormulaC13H8BrClFN3
Molecular Weight340.58 g/mol
Exact Mass338.96
IUPAC Name5-bromo-N-(4-chloro-2-fluorophenyl)-1H-indazol-3-amine
SMILESFc1cc(Cl)ccc1Nc1n[nH]c2ccc(Br)cc12
InChIInChI=1S/C13H8BrClFN3/c14-7-1-3-11-9(5-7)13(19-18-11)17-12-4-2-8(15)6-10(12)16/h1-6H,(H2,17,18,19)
InChIKeyLAUPFEFJZWRXER-UHFFFAOYSA-N
XLogP4.86
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.58
LogP ≤ 54.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

5-chloro-N-(3-chlorophenyl)-1H-indazol-3-amine
CID 24987277
5-bromo-N-(3-chlorophenyl)-1H-indazol-3-amine
CID 24991333
N-(3-chlorophenyl)-5-methyl-1H-indazol-3-amine
CID 24991696
N-(3-fluorophenyl)-1H-indazol-3-amine
CID 25096268
N-(3-chlorophenyl)-1H-indazol-3-amine
CID 25096270
N-(3-chlorophenyl)-5-fluoro-1H-indazol-3-amine
CID 25096271
8-bromo-4-N-(4-chlorophenyl)-1H-pyrazolo[4,5-c]quinoline-3,4-diamine
CID 124093773
N-(3-chlorophenyl)-5-(trifluoromethyl)-1H-indazol-3-amine
CID 122187124
6-chloro-N-(3,4-difluorophenyl)-1H-indazol-3-amine
CID 137642738
N-(4-Chlorophenyl)-6-(trifluoromethyl)-1H-indazol-3-amine
CID 137652927
N-(4-chlorophenyl)-1H-indazol-3-amine
CID 137646167
N-(3-chlorophenyl)-5,7-difluoro-1H-indazol-3-amine
CID 24987278

Frequently Asked Questions

What is the IUPAC name of 5-bromo-N-(4-chloro-2-fluorophenyl)-1H-indazol-3-amine?
The IUPAC name of 5-bromo-N-(4-chloro-2-fluorophenyl)-1H-indazol-3-amine (CID 143548220) is 5-bromo-N-(4-chloro-2-fluorophenyl)-1H-indazol-3-amine.
What is the SMILES notation for 5-bromo-N-(4-chloro-2-fluorophenyl)-1H-indazol-3-amine?
The canonical SMILES for 5-bromo-N-(4-chloro-2-fluorophenyl)-1H-indazol-3-amine is Fc1cc(Cl)ccc1Nc1n[nH]c2ccc(Br)cc12.
What is the InChIKey of 5-bromo-N-(4-chloro-2-fluorophenyl)-1H-indazol-3-amine?
The InChIKey is LAUPFEFJZWRXER-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H8BrClFN3/c14-7-1-3-11-9(5-7)13(19-18-11)17-12-4-2-8(15)6-10(12)16/h1-6H,(H2,17,18,19).
What are the key properties of 5-bromo-N-(4-chloro-2-fluorophenyl)-1H-indazol-3-amine?
5-bromo-N-(4-chloro-2-fluorophenyl)-1H-indazol-3-amine has a molecular weight of 340.58 g/mol, XLogP of 4.86, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N-(4-chloro-2-fluorophenyl)-1H-indazol-3-amine is sourced from PubChem (CID 143548220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).