(NZ)-N-(2,2-dimethyl-1-azabicyclo[2.2.1]heptan-3-ylidene)hydroxylamine

C8H14N2O — CID 139541469

IUPAC(NZ)-N-(2,2-dimethyl-1-azabicyclo[2.2.1]heptan-3-ylidene)hydroxylamine
SMILESCC1(C)/C(=N\O)C2CCN1C2
InChIInChI=1S/C8H14N2O/c1-8(2)7(9-11)6-3-4-10(8)5-6/h6,11H,3-5H2,1-2H3/b9-7-
InChIKeyAESJVRIDCGTZRS-CLFYSBASSA-N
MW154.21 g/mol
LogP0.93
Rot. Bonds

About (NZ)-N-(2,2-dimethyl-1-azabicyclo[2.2.1]heptan-3-ylidene)hydroxylamine

(NZ)-N-(2,2-dimethyl-1-azabicyclo[2.2.1]heptan-3-ylidene)hydroxylamine (PubChem CID 139541469) has the molecular formula C8H14N2O and a molecular weight of 154.21 g/mol. Its IUPAC name is (NZ)-N-(2,2-dimethyl-1-azabicyclo[2.2.1]heptan-3-ylidene)hydroxylamine.

Molecular Properties

Compound Name(NZ)-N-(2,2-dimethyl-1-azabicyclo[2.2.1]heptan-3-ylidene)hydroxylamine
PubChem CID139541469
Molecular FormulaC8H14N2O
Molecular Weight154.21 g/mol
Exact Mass154.11
IUPAC Name(NZ)-N-(2,2-dimethyl-1-azabicyclo[2.2.1]heptan-3-ylidene)hydroxylamine
SMILESCC1(C)/C(=N\O)C2CCN1C2
InChIInChI=1S/C8H14N2O/c1-8(2)7(9-11)6-3-4-10(8)5-6/h6,11H,3-5H2,1-2H3/b9-7-
InChIKeyAESJVRIDCGTZRS-CLFYSBASSA-N
XLogP0.93
TPSA35.83 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.21
LogP ≤ 50.93
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 (NZ)-N-(2,2-dimethyl-1-azabicyclo[2.2.1]heptan-3-ylidene)hydroxylamine?
The IUPAC name of (NZ)-N-(2,2-dimethyl-1-azabicyclo[2.2.1]heptan-3-ylidene)hydroxylamine (CID 139541469) is (NZ)-N-(2,2-dimethyl-1-azabicyclo[2.2.1]heptan-3-ylidene)hydroxylamine.
What is the SMILES notation for (NZ)-N-(2,2-dimethyl-1-azabicyclo[2.2.1]heptan-3-ylidene)hydroxylamine?
The canonical SMILES for (NZ)-N-(2,2-dimethyl-1-azabicyclo[2.2.1]heptan-3-ylidene)hydroxylamine is CC1(C)/C(=N\O)C2CCN1C2.
What is the InChIKey of (NZ)-N-(2,2-dimethyl-1-azabicyclo[2.2.1]heptan-3-ylidene)hydroxylamine?
The InChIKey is AESJVRIDCGTZRS-CLFYSBASSA-N. The full InChI is InChI=1S/C8H14N2O/c1-8(2)7(9-11)6-3-4-10(8)5-6/h6,11H,3-5H2,1-2H3/b9-7-.
What are the key properties of (NZ)-N-(2,2-dimethyl-1-azabicyclo[2.2.1]heptan-3-ylidene)hydroxylamine?
(NZ)-N-(2,2-dimethyl-1-azabicyclo[2.2.1]heptan-3-ylidene)hydroxylamine has a molecular weight of 154.21 g/mol, XLogP of 0.93, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (NZ)-N-(2,2-dimethyl-1-azabicyclo[2.2.1]heptan-3-ylidene)hydroxylamine is sourced from PubChem (CID 139541469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).