N-(2,2-dimethyl-1-oxaspiro[4.5]decan-4-ylidene)hydroxylamine

C11H19NO2 — CID 74040230

IUPACN-(2,2-dimethyl-1-oxaspiro[4.5]decan-4-ylidene)hydroxylamine
SMILESCC1(C)CC(=NO)C2(CCCCC2)O1
InChIInChI=1S/C11H19NO2/c1-10(2)8-9(12-13)11(14-10)6-4-3-5-7-11/h13H,3-8H2,1-2H3
InChIKeyMAUNNCALTPZRJF-UHFFFAOYSA-N
MW197.28 g/mol
LogP2.72
Rot. Bonds

About N-(2,2-dimethyl-1-oxaspiro[4.5]decan-4-ylidene)hydroxylamine

N-(2,2-dimethyl-1-oxaspiro[4.5]decan-4-ylidene)hydroxylamine (PubChem CID 74040230) has the molecular formula C11H19NO2 and a molecular weight of 197.28 g/mol. Its IUPAC name is N-(2,2-dimethyl-1-oxaspiro[4.5]decan-4-ylidene)hydroxylamine.

Molecular Properties

Compound NameN-(2,2-dimethyl-1-oxaspiro[4.5]decan-4-ylidene)hydroxylamine
PubChem CID74040230
Molecular FormulaC11H19NO2
Molecular Weight197.28 g/mol
Exact Mass197.14
IUPAC NameN-(2,2-dimethyl-1-oxaspiro[4.5]decan-4-ylidene)hydroxylamine
SMILESCC1(C)CC(=NO)C2(CCCCC2)O1
InChIInChI=1S/C11H19NO2/c1-10(2)8-9(12-13)11(14-10)6-4-3-5-7-11/h13H,3-8H2,1-2H3
InChIKeyMAUNNCALTPZRJF-UHFFFAOYSA-N
XLogP2.72
TPSA41.82 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.28
LogP ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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-(2,2-dimethyl-1-oxaspiro[4.5]decan-4-ylidene)hydroxylamine?
The IUPAC name of N-(2,2-dimethyl-1-oxaspiro[4.5]decan-4-ylidene)hydroxylamine (CID 74040230) is N-(2,2-dimethyl-1-oxaspiro[4.5]decan-4-ylidene)hydroxylamine.
What is the SMILES notation for N-(2,2-dimethyl-1-oxaspiro[4.5]decan-4-ylidene)hydroxylamine?
The canonical SMILES for N-(2,2-dimethyl-1-oxaspiro[4.5]decan-4-ylidene)hydroxylamine is CC1(C)CC(=NO)C2(CCCCC2)O1.
What is the InChIKey of N-(2,2-dimethyl-1-oxaspiro[4.5]decan-4-ylidene)hydroxylamine?
The InChIKey is MAUNNCALTPZRJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO2/c1-10(2)8-9(12-13)11(14-10)6-4-3-5-7-11/h13H,3-8H2,1-2H3.
What are the key properties of N-(2,2-dimethyl-1-oxaspiro[4.5]decan-4-ylidene)hydroxylamine?
N-(2,2-dimethyl-1-oxaspiro[4.5]decan-4-ylidene)hydroxylamine has a molecular weight of 197.28 g/mol, XLogP of 2.72, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2-dimethyl-1-oxaspiro[4.5]decan-4-ylidene)hydroxylamine is sourced from PubChem (CID 74040230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).