5-bromo-1H-indazol-6-ol

C7H5BrN2O — CID 135742438

IUPAC5-bromo-1H-indazol-6-ol
SMILESOc1cc2[nH]ncc2cc1Br
InChIInChI=1S/C7H5BrN2O/c8-5-1-4-3-9-10-6(4)2-7(5)11/h1-3,11H,(H,9,10)
InChIKeySAMGFFSJTFRHJM-UHFFFAOYSA-N
MW213.03 g/mol
LogP2.03
Rot. Bonds

About 5-bromo-1H-indazol-6-ol

5-bromo-1H-indazol-6-ol (PubChem CID 135742438) has the molecular formula C7H5BrN2O and a molecular weight of 213.03 g/mol. Its IUPAC name is 5-bromo-1H-indazol-6-ol.

Molecular Properties

Compound Name5-bromo-1H-indazol-6-ol
PubChem CID135742438
Molecular FormulaC7H5BrN2O
Molecular Weight213.03 g/mol
Exact Mass211.96
IUPAC Name5-bromo-1H-indazol-6-ol
SMILESOc1cc2[nH]ncc2cc1Br
InChIInChI=1S/C7H5BrN2O/c8-5-1-4-3-9-10-6(4)2-7(5)11/h1-3,11H,(H,9,10)
InChIKeySAMGFFSJTFRHJM-UHFFFAOYSA-N
XLogP2.03
TPSA48.91 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.03
LogP ≤ 52.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

5-methyl-1H-indazol-6-ol
CID 135742461
5-bromo-6-fluoro-1H-indazole
CID 46863923
6-bromo-5-iodo-1H-indazole
CID 156619372
N-(5-bromo-1H-indazol-6-yl)formamide
CID 168653243
6-hydroxy-1H-indazole-5-carboxylic acid
CID 135742459
5-bromo-N-(4-fluorophenyl)-1H-indazol-6-amine
CID 146486341
5-hydroxy-1H-indazole-6-carboxylic acid
CID 76846394
5-bromo-N-[(2-chloro-1,3-thiazol-5-yl)methyl]-1H-indazol-6-amine
CID 168582775
6-N-(2,5-dibromophenyl)-1H-indazole-5,6-diamine
CID 107489373
6-fluoro-5-iodo-1H-indazole
CID 70970480
5,6-diethyl-1H-indazole
CID 123175477
tert-butyl N-(6-bromo-1H-indazol-5-yl)carbamate
CID 118182563

Frequently Asked Questions

What is the IUPAC name of 5-bromo-1H-indazol-6-ol?
The IUPAC name of 5-bromo-1H-indazol-6-ol (CID 135742438) is 5-bromo-1H-indazol-6-ol.
What is the SMILES notation for 5-bromo-1H-indazol-6-ol?
The canonical SMILES for 5-bromo-1H-indazol-6-ol is Oc1cc2[nH]ncc2cc1Br.
What is the InChIKey of 5-bromo-1H-indazol-6-ol?
The InChIKey is SAMGFFSJTFRHJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5BrN2O/c8-5-1-4-3-9-10-6(4)2-7(5)11/h1-3,11H,(H,9,10).
What are the key properties of 5-bromo-1H-indazol-6-ol?
5-bromo-1H-indazol-6-ol has a molecular weight of 213.03 g/mol, XLogP of 2.03, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-1H-indazol-6-ol is sourced from PubChem (CID 135742438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).