2-hydroxy-1H-indole-3-diazonium

C8H6N3O+ — CID 555023

IUPAC2-hydroxy-1H-indole-3-diazonium
SMILESN#[N+]c1c(O)[nH]c2ccccc12
InChIInChI=1S/C8H5N3O/c9-11-7-5-3-1-2-4-6(5)10-8(7)12/h1-4,9H/p+1
InChIKeyJUWOBCNAWKDBSM-UHFFFAOYSA-O
MW160.16 g/mol
LogP2.36
Rot. Bonds

About 2-hydroxy-1H-indole-3-diazonium

2-hydroxy-1H-indole-3-diazonium (PubChem CID 555023) has the molecular formula C8H6N3O+ and a molecular weight of 160.16 g/mol. Its IUPAC name is 2-hydroxy-1H-indole-3-diazonium.

Molecular Properties

Compound Name2-hydroxy-1H-indole-3-diazonium
PubChem CID555023
Molecular FormulaC8H6N3O+
Molecular Weight160.16 g/mol
Exact Mass160.05
IUPAC Name2-hydroxy-1H-indole-3-diazonium
SMILESN#[N+]c1c(O)[nH]c2ccccc12
InChIInChI=1S/C8H5N3O/c9-11-7-5-3-1-2-4-6(5)10-8(7)12/h1-4,9H/p+1
InChIKeyJUWOBCNAWKDBSM-UHFFFAOYSA-O
XLogP2.36
TPSA64.17 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.16
LogP ≤ 52.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Azo_group', 'substructure': 'N/A'}

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Related Compounds

3-diazonio-1H-indol-2-olate
CID 555022
2-(diethylcarbamoyl)-1H-indole-3-diazonium
CID 10752674
3-[(2-hydroxy-1H-indol-3-yl)methyl]-1H-indol-2-ol
CID 11959861
CID 131863122
CID 131863122
9H-carbazole
CID 66668984
3-(trifluoromethyl)-1H-indol-2-ol
CID 154142036
9H-carbazole;copper
CID 159878189
bis(9H-carbazole);platinum(2+)
CID 175826437
CID 70460275
CID 70460275
(2-hydroxy-1H-indol-3-yl)iminothiourea
CID 690109
3-(N-ethyl-C-methylcarbonimidoyl)-1H-indol-2-ol
CID 141126258
N-(2-hydroxy-1H-indol-3-yl)acetamide
CID 3244306

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-1H-indole-3-diazonium?
The IUPAC name of 2-hydroxy-1H-indole-3-diazonium (CID 555023) is 2-hydroxy-1H-indole-3-diazonium.
What is the SMILES notation for 2-hydroxy-1H-indole-3-diazonium?
The canonical SMILES for 2-hydroxy-1H-indole-3-diazonium is N#[N+]c1c(O)[nH]c2ccccc12.
What is the InChIKey of 2-hydroxy-1H-indole-3-diazonium?
The InChIKey is JUWOBCNAWKDBSM-UHFFFAOYSA-O. The full InChI is InChI=1S/C8H5N3O/c9-11-7-5-3-1-2-4-6(5)10-8(7)12/h1-4,9H/p+1.
What are the key properties of 2-hydroxy-1H-indole-3-diazonium?
2-hydroxy-1H-indole-3-diazonium has a molecular weight of 160.16 g/mol, XLogP of 2.36, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-1H-indole-3-diazonium is sourced from PubChem (CID 555023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).