N-(5-oxa-8-azaspiro[3.5]nonan-2-ylidene)hydroxylamine

C7H12N2O2 — CID 155131224

IUPACN-(5-oxa-8-azaspiro[3.5]nonan-2-ylidene)hydroxylamine
SMILESON=C1CC2(CNCCO2)C1
InChIInChI=1S/C7H12N2O2/c10-9-6-3-7(4-6)5-8-1-2-11-7/h8,10H,1-5H2/b9-6-
InChIKeyLSQRDEVBYRFWIQ-TWGQIWQCSA-N
MW156.18 g/mol
LogP-0.03
Rot. Bonds

About N-(5-oxa-8-azaspiro[3.5]nonan-2-ylidene)hydroxylamine

N-(5-oxa-8-azaspiro[3.5]nonan-2-ylidene)hydroxylamine (PubChem CID 155131224) has the molecular formula C7H12N2O2 and a molecular weight of 156.18 g/mol. Its IUPAC name is N-(5-oxa-8-azaspiro[3.5]nonan-2-ylidene)hydroxylamine.

Molecular Properties

Compound NameN-(5-oxa-8-azaspiro[3.5]nonan-2-ylidene)hydroxylamine
PubChem CID155131224
Molecular FormulaC7H12N2O2
Molecular Weight156.18 g/mol
Exact Mass156.09
IUPAC NameN-(5-oxa-8-azaspiro[3.5]nonan-2-ylidene)hydroxylamine
SMILESON=C1CC2(CNCCO2)C1
InChIInChI=1S/C7H12N2O2/c10-9-6-3-7(4-6)5-8-1-2-11-7/h8,10H,1-5H2/b9-6-
InChIKeyLSQRDEVBYRFWIQ-TWGQIWQCSA-N
XLogP-0.03
TPSA53.85 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.18
LogP ≤ 5-0.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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-(5-oxa-8-azaspiro[3.5]nonan-2-ylidene)hydroxylamine?
The IUPAC name of N-(5-oxa-8-azaspiro[3.5]nonan-2-ylidene)hydroxylamine (CID 155131224) is N-(5-oxa-8-azaspiro[3.5]nonan-2-ylidene)hydroxylamine.
What is the SMILES notation for N-(5-oxa-8-azaspiro[3.5]nonan-2-ylidene)hydroxylamine?
The canonical SMILES for N-(5-oxa-8-azaspiro[3.5]nonan-2-ylidene)hydroxylamine is ON=C1CC2(CNCCO2)C1.
What is the InChIKey of N-(5-oxa-8-azaspiro[3.5]nonan-2-ylidene)hydroxylamine?
The InChIKey is LSQRDEVBYRFWIQ-TWGQIWQCSA-N. The full InChI is InChI=1S/C7H12N2O2/c10-9-6-3-7(4-6)5-8-1-2-11-7/h8,10H,1-5H2/b9-6-.
What are the key properties of N-(5-oxa-8-azaspiro[3.5]nonan-2-ylidene)hydroxylamine?
N-(5-oxa-8-azaspiro[3.5]nonan-2-ylidene)hydroxylamine has a molecular weight of 156.18 g/mol, XLogP of -0.03, 0 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-oxa-8-azaspiro[3.5]nonan-2-ylidene)hydroxylamine is sourced from PubChem (CID 155131224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).