(NE)-N-cyclohex-2-en-1-ylidenehydroxylamine

C6H9NO — CID 5365545

IUPAC(NE)-N-cyclohex-2-en-1-ylidenehydroxylamine
SMILESO/N=C1/C=CCCC1
InChIInChI=1S/C6H9NO/c8-7-6-4-2-1-3-5-6/h2,4,8H,1,3,5H2/b7-6-
InChIKeyWNPVAXLJVUXYFU-SREVYHEPSA-N
MW111.14 g/mol
LogP1.56
Rot. Bonds

About (NE)-N-cyclohex-2-en-1-ylidenehydroxylamine

(NE)-N-cyclohex-2-en-1-ylidenehydroxylamine (PubChem CID 5365545) has the molecular formula C6H9NO and a molecular weight of 111.14 g/mol. Its IUPAC name is (NE)-N-cyclohex-2-en-1-ylidenehydroxylamine.

Molecular Properties

Compound Name(NE)-N-cyclohex-2-en-1-ylidenehydroxylamine
PubChem CID5365545
Molecular FormulaC6H9NO
Molecular Weight111.14 g/mol
Exact Mass111.07
IUPAC Name(NE)-N-cyclohex-2-en-1-ylidenehydroxylamine
SMILESO/N=C1/C=CCCC1
InChIInChI=1S/C6H9NO/c8-7-6-4-2-1-3-5-6/h2,4,8H,1,3,5H2/b7-6-
InChIKeyWNPVAXLJVUXYFU-SREVYHEPSA-N
XLogP1.56
TPSA32.59 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500111.14
LogP ≤ 51.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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 (NE)-N-cyclohex-2-en-1-ylidenehydroxylamine?
The IUPAC name of (NE)-N-cyclohex-2-en-1-ylidenehydroxylamine (CID 5365545) is (NE)-N-cyclohex-2-en-1-ylidenehydroxylamine.
What is the SMILES notation for (NE)-N-cyclohex-2-en-1-ylidenehydroxylamine?
The canonical SMILES for (NE)-N-cyclohex-2-en-1-ylidenehydroxylamine is O/N=C1/C=CCCC1.
What is the InChIKey of (NE)-N-cyclohex-2-en-1-ylidenehydroxylamine?
The InChIKey is WNPVAXLJVUXYFU-SREVYHEPSA-N. The full InChI is InChI=1S/C6H9NO/c8-7-6-4-2-1-3-5-6/h2,4,8H,1,3,5H2/b7-6-.
What are the key properties of (NE)-N-cyclohex-2-en-1-ylidenehydroxylamine?
(NE)-N-cyclohex-2-en-1-ylidenehydroxylamine has a molecular weight of 111.14 g/mol, XLogP of 1.56, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (NE)-N-cyclohex-2-en-1-ylidenehydroxylamine is sourced from PubChem (CID 5365545), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).