O-indol-1-ylhydroxylamine

C8H8N2O — CID 57016853

IUPACO-indol-1-ylhydroxylamine
SMILESNOn1ccc2ccccc21
InChIInChI=1S/C8H8N2O/c9-11-10-6-5-7-3-1-2-4-8(7)10/h1-6H,9H2
InChIKeyNCLSRYOVYSTEKH-UHFFFAOYSA-N
MW148.16 g/mol
LogP0.94
Rot. Bonds1

About O-indol-1-ylhydroxylamine

O-indol-1-ylhydroxylamine (PubChem CID 57016853) has the molecular formula C8H8N2O and a molecular weight of 148.16 g/mol. Its IUPAC name is O-indol-1-ylhydroxylamine.

Molecular Properties

Compound NameO-indol-1-ylhydroxylamine
PubChem CID57016853
Molecular FormulaC8H8N2O
Molecular Weight148.16 g/mol
Exact Mass148.06
IUPAC NameO-indol-1-ylhydroxylamine
SMILESNOn1ccc2ccccc21
InChIInChI=1S/C8H8N2O/c9-11-10-6-5-7-3-1-2-4-8(7)10/h1-6H,9H2
InChIKeyNCLSRYOVYSTEKH-UHFFFAOYSA-N
XLogP0.94
TPSA40.18 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.16
LogP ≤ 50.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

Indole
CID 798
Skatole
CID 6736
Tryptamine
CID 1150
N,N-Dimethyltryptamine
CID 6089
Quinoline
CID 7047
Gramine
CID 6890
(+-)-alpha-Methyltryptamine
CID 9287
Methyltryptamine
CID 6088
Indalpine
CID 44668
Alpha-Ethyltryptamine
CID 8367
Indole-3-acetonitrile
CID 351795
N,N-Diethyltryptamine
CID 6090

Frequently Asked Questions

What is the IUPAC name of O-indol-1-ylhydroxylamine?
The IUPAC name of O-indol-1-ylhydroxylamine (CID 57016853) is O-indol-1-ylhydroxylamine.
What is the SMILES notation for O-indol-1-ylhydroxylamine?
The canonical SMILES for O-indol-1-ylhydroxylamine is NOn1ccc2ccccc21.
What is the InChIKey of O-indol-1-ylhydroxylamine?
The InChIKey is NCLSRYOVYSTEKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8N2O/c9-11-10-6-5-7-3-1-2-4-8(7)10/h1-6H,9H2.
What are the key properties of O-indol-1-ylhydroxylamine?
O-indol-1-ylhydroxylamine has a molecular weight of 148.16 g/mol, XLogP of 0.94, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for O-indol-1-ylhydroxylamine is sourced from PubChem (CID 57016853), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).