N-(azulen-6-ylmethylidene)hydroxylamine

C11H9NO — CID 73184151

IUPACN-(azulen-6-ylmethylidene)hydroxylamine
SMILESON=Cc1ccc2cccc-2cc1
InChIInChI=1S/C11H9NO/c13-12-8-9-4-6-10-2-1-3-11(10)7-5-9/h1-8,13H
InChIKeyWYHIKSGNVGHONN-UHFFFAOYSA-N
MW171.20 g/mol
LogP2.60
Rot. Bonds1

About N-(azulen-6-ylmethylidene)hydroxylamine

N-(azulen-6-ylmethylidene)hydroxylamine (PubChem CID 73184151) has the molecular formula C11H9NO and a molecular weight of 171.20 g/mol. Its IUPAC name is N-(azulen-6-ylmethylidene)hydroxylamine.

Molecular Properties

Compound NameN-(azulen-6-ylmethylidene)hydroxylamine
PubChem CID73184151
Molecular FormulaC11H9NO
Molecular Weight171.20 g/mol
Exact Mass171.07
IUPAC NameN-(azulen-6-ylmethylidene)hydroxylamine
SMILESON=Cc1ccc2cccc-2cc1
InChIInChI=1S/C11H9NO/c13-12-8-9-4-6-10-2-1-3-11(10)7-5-9/h1-8,13H
InChIKeyWYHIKSGNVGHONN-UHFFFAOYSA-N
XLogP2.60
TPSA32.59 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.20
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'oxime_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(azulen-6-ylmethylidene)hydroxylamine?
The IUPAC name of N-(azulen-6-ylmethylidene)hydroxylamine (CID 73184151) is N-(azulen-6-ylmethylidene)hydroxylamine.
What is the SMILES notation for N-(azulen-6-ylmethylidene)hydroxylamine?
The canonical SMILES for N-(azulen-6-ylmethylidene)hydroxylamine is ON=Cc1ccc2cccc-2cc1.
What is the InChIKey of N-(azulen-6-ylmethylidene)hydroxylamine?
The InChIKey is WYHIKSGNVGHONN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9NO/c13-12-8-9-4-6-10-2-1-3-11(10)7-5-9/h1-8,13H.
What are the key properties of N-(azulen-6-ylmethylidene)hydroxylamine?
N-(azulen-6-ylmethylidene)hydroxylamine has a molecular weight of 171.20 g/mol, XLogP of 2.60, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(azulen-6-ylmethylidene)hydroxylamine is sourced from PubChem (CID 73184151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).