(NZ)-N-(3-prop-2-enyl-2-bicyclo[2.2.2]octanylidene)hydroxylamine

C11H17NO — CID 58974251

IUPAC(NZ)-N-(3-prop-2-enyl-2-bicyclo[2.2.2]octanylidene)hydroxylamine
SMILESC=CCC1/C(=N\O)C2CCC1CC2
InChIInChI=1S/C11H17NO/c1-2-3-10-8-4-6-9(7-5-8)11(10)12-13/h2,8-10,13H,1,3-7H2/b12-11-
InChIKeyAWKNXTRVUGCTNR-QXMHVHEDSA-N
MW179.26 g/mol
LogP2.83
Rot. Bonds2

About (NZ)-N-(3-prop-2-enyl-2-bicyclo[2.2.2]octanylidene)hydroxylamine

(NZ)-N-(3-prop-2-enyl-2-bicyclo[2.2.2]octanylidene)hydroxylamine (PubChem CID 58974251) has the molecular formula C11H17NO and a molecular weight of 179.26 g/mol. Its IUPAC name is (NZ)-N-(3-prop-2-enyl-2-bicyclo[2.2.2]octanylidene)hydroxylamine.

Molecular Properties

Compound Name(NZ)-N-(3-prop-2-enyl-2-bicyclo[2.2.2]octanylidene)hydroxylamine
PubChem CID58974251
Molecular FormulaC11H17NO
Molecular Weight179.26 g/mol
Exact Mass179.13
IUPAC Name(NZ)-N-(3-prop-2-enyl-2-bicyclo[2.2.2]octanylidene)hydroxylamine
SMILESC=CCC1/C(=N\O)C2CCC1CC2
InChIInChI=1S/C11H17NO/c1-2-3-10-8-4-6-9(7-5-8)11(10)12-13/h2,8-10,13H,1,3-7H2/b12-11-
InChIKeyAWKNXTRVUGCTNR-QXMHVHEDSA-N
XLogP2.83
TPSA32.59 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.26
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', '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 (NZ)-N-(3-prop-2-enyl-2-bicyclo[2.2.2]octanylidene)hydroxylamine?
The IUPAC name of (NZ)-N-(3-prop-2-enyl-2-bicyclo[2.2.2]octanylidene)hydroxylamine (CID 58974251) is (NZ)-N-(3-prop-2-enyl-2-bicyclo[2.2.2]octanylidene)hydroxylamine.
What is the SMILES notation for (NZ)-N-(3-prop-2-enyl-2-bicyclo[2.2.2]octanylidene)hydroxylamine?
The canonical SMILES for (NZ)-N-(3-prop-2-enyl-2-bicyclo[2.2.2]octanylidene)hydroxylamine is C=CCC1/C(=N\O)C2CCC1CC2.
What is the InChIKey of (NZ)-N-(3-prop-2-enyl-2-bicyclo[2.2.2]octanylidene)hydroxylamine?
The InChIKey is AWKNXTRVUGCTNR-QXMHVHEDSA-N. The full InChI is InChI=1S/C11H17NO/c1-2-3-10-8-4-6-9(7-5-8)11(10)12-13/h2,8-10,13H,1,3-7H2/b12-11-.
What are the key properties of (NZ)-N-(3-prop-2-enyl-2-bicyclo[2.2.2]octanylidene)hydroxylamine?
(NZ)-N-(3-prop-2-enyl-2-bicyclo[2.2.2]octanylidene)hydroxylamine has a molecular weight of 179.26 g/mol, XLogP of 2.83, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (NZ)-N-(3-prop-2-enyl-2-bicyclo[2.2.2]octanylidene)hydroxylamine is sourced from PubChem (CID 58974251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).