5-bromo-N-(3-chlorophenyl)-1H-indazol-3-amine

C13H9BrClN3 — CID 24991333

IUPAC5-bromo-N-(3-chlorophenyl)-1H-indazol-3-amine
SMILESClc1cccc(Nc2n[nH]c3ccc(Br)cc23)c1
InChIInChI=1S/C13H9BrClN3/c14-8-4-5-12-11(6-8)13(18-17-12)16-10-3-1-2-9(15)7-10/h1-7H,(H2,16,17,18)
InChIKeyMVICOBWRRZQMNQ-UHFFFAOYSA-N
MW322.59 g/mol
LogP4.72
Rot. Bonds2

About 5-bromo-N-(3-chlorophenyl)-1H-indazol-3-amine

5-bromo-N-(3-chlorophenyl)-1H-indazol-3-amine (PubChem CID 24991333) has the molecular formula C13H9BrClN3 and a molecular weight of 322.59 g/mol. Its IUPAC name is 5-bromo-N-(3-chlorophenyl)-1H-indazol-3-amine.

Molecular Properties

Compound Name5-bromo-N-(3-chlorophenyl)-1H-indazol-3-amine
PubChem CID24991333
Molecular FormulaC13H9BrClN3
Molecular Weight322.59 g/mol
Exact Mass320.97
IUPAC Name5-bromo-N-(3-chlorophenyl)-1H-indazol-3-amine
SMILESClc1cccc(Nc2n[nH]c3ccc(Br)cc23)c1
InChIInChI=1S/C13H9BrClN3/c14-8-4-5-12-11(6-8)13(18-17-12)16-10-3-1-2-9(15)7-10/h1-7H,(H2,16,17,18)
InChIKeyMVICOBWRRZQMNQ-UHFFFAOYSA-N
XLogP4.72
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.59
LogP ≤ 54.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(5-bromo-6-chloro-1H-indazol-3-yl)butanamide
CID 10087157
5-chloro-N-(3-chlorophenyl)-1H-indazol-3-amine
CID 24987277
N-(3-chlorophenyl)-5-methyl-1H-indazol-3-amine
CID 24991696
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-phenyl-1H-indazol-3-amine
CID 12890113
N-(3-chlorophenyl)-5,7-difluoro-1H-indazol-3-amine
CID 24987278

Frequently Asked Questions

What is the IUPAC name of 5-bromo-N-(3-chlorophenyl)-1H-indazol-3-amine?
The IUPAC name of 5-bromo-N-(3-chlorophenyl)-1H-indazol-3-amine (CID 24991333) is 5-bromo-N-(3-chlorophenyl)-1H-indazol-3-amine.
What is the SMILES notation for 5-bromo-N-(3-chlorophenyl)-1H-indazol-3-amine?
The canonical SMILES for 5-bromo-N-(3-chlorophenyl)-1H-indazol-3-amine is Clc1cccc(Nc2n[nH]c3ccc(Br)cc23)c1.
What is the InChIKey of 5-bromo-N-(3-chlorophenyl)-1H-indazol-3-amine?
The InChIKey is MVICOBWRRZQMNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9BrClN3/c14-8-4-5-12-11(6-8)13(18-17-12)16-10-3-1-2-9(15)7-10/h1-7H,(H2,16,17,18).
What are the key properties of 5-bromo-N-(3-chlorophenyl)-1H-indazol-3-amine?
5-bromo-N-(3-chlorophenyl)-1H-indazol-3-amine has a molecular weight of 322.59 g/mol, XLogP of 4.72, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N-(3-chlorophenyl)-1H-indazol-3-amine is sourced from PubChem (CID 24991333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).