(NE)-N-octylidenehydroxylamine

C8H17NO — CID 5385260

IUPAC(NE)-N-octylidenehydroxylamine
SMILESCCCCCCC/C=N/O
InChIInChI=1S/C8H17NO/c1-2-3-4-5-6-7-8-9-10/h8,10H,2-7H2,1H3/b9-8+
InChIKeyGGZXEEFQIXMFBF-CMDGGOBGSA-N
MW143.23 g/mol
LogP2.81
Rot. Bonds6

About (NE)-N-octylidenehydroxylamine

(NE)-N-octylidenehydroxylamine (PubChem CID 5385260) has the molecular formula C8H17NO and a molecular weight of 143.23 g/mol. Its IUPAC name is (NE)-N-octylidenehydroxylamine.

Molecular Properties

Compound Name(NE)-N-octylidenehydroxylamine
PubChem CID5385260
Molecular FormulaC8H17NO
Molecular Weight143.23 g/mol
Exact Mass143.13
IUPAC Name(NE)-N-octylidenehydroxylamine
SMILESCCCCCCC/C=N/O
InChIInChI=1S/C8H17NO/c1-2-3-4-5-6-7-8-9-10/h8,10H,2-7H2,1H3/b9-8+
InChIKeyGGZXEEFQIXMFBF-CMDGGOBGSA-N
XLogP2.81
TPSA32.59 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.23
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'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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Related Compounds

N-(12-hydroxyiminododecylidene)hydroxylamine
CID 131876535
(NE)-N-[(Z)-dec-4-enylidene]hydroxylamine
CID 134985114
(N'Z)-N'-heptylidene-N-[7-[(Z)-[(7E)-7-hydroxyiminoheptylidene]-oxidoazaniumyl]heptyl]heptane-1,7-diimine oxide
CID 177447848
N-(pentadecylideneamino)pentadecan-1-imine
CID 88831518
(NE)-N-[(5Z)-5-hydroxyiminopentylidene]hydroxylamine
CID 5356166
N-dec-9-enylidenehydroxylamine
CID 175541628
N-methyloctadecan-1-imine
CID 54409483
N-(dodecylideneamino)hydroxylamine
CID 91556209
[(E)-heptylideneamino]-trimethylazanium iodide
CID 54607159
N-hept-6-enylidenehydroxylamine
CID 153435939
N-pentacosylhexacosan-1-imine
CID 21412184
N-hexacosylheptacosan-1-imine
CID 88829034

Frequently Asked Questions

What is the IUPAC name of (NE)-N-octylidenehydroxylamine?
The IUPAC name of (NE)-N-octylidenehydroxylamine (CID 5385260) is (NE)-N-octylidenehydroxylamine.
What is the SMILES notation for (NE)-N-octylidenehydroxylamine?
The canonical SMILES for (NE)-N-octylidenehydroxylamine is CCCCCCC/C=N/O.
What is the InChIKey of (NE)-N-octylidenehydroxylamine?
The InChIKey is GGZXEEFQIXMFBF-CMDGGOBGSA-N. The full InChI is InChI=1S/C8H17NO/c1-2-3-4-5-6-7-8-9-10/h8,10H,2-7H2,1H3/b9-8+.
What are the key properties of (NE)-N-octylidenehydroxylamine?
(NE)-N-octylidenehydroxylamine has a molecular weight of 143.23 g/mol, XLogP of 2.81, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (NE)-N-octylidenehydroxylamine is sourced from PubChem (CID 5385260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).