(NE)-N-(2-ethylhexylidene)hydroxylamine

C8H17NO — CID 11252077

IUPAC(NE)-N-(2-ethylhexylidene)hydroxylamine
SMILESCCCCC(/C=N/O)CC
InChIInChI=1S/C8H17NO/c1-3-5-6-8(4-2)7-9-10/h7-8,10H,3-6H2,1-2H3/b9-7+
InChIKeyIYFCZUKVNNVJIJ-VQHVLOKHSA-N
MW143.23 g/mol
LogP2.66
Rot. Bonds5

About (NE)-N-(2-ethylhexylidene)hydroxylamine

(NE)-N-(2-ethylhexylidene)hydroxylamine (PubChem CID 11252077) has the molecular formula C8H17NO and a molecular weight of 143.23 g/mol. Its IUPAC name is (NE)-N-(2-ethylhexylidene)hydroxylamine.

Molecular Properties

Compound Name(NE)-N-(2-ethylhexylidene)hydroxylamine
PubChem CID11252077
Molecular FormulaC8H17NO
Molecular Weight143.23 g/mol
Exact Mass143.13
IUPAC Name(NE)-N-(2-ethylhexylidene)hydroxylamine
SMILESCCCCC(/C=N/O)CC
InChIInChI=1S/C8H17NO/c1-3-5-6-8(4-2)7-9-10/h7-8,10H,3-6H2,1-2H3/b9-7+
InChIKeyIYFCZUKVNNVJIJ-VQHVLOKHSA-N
XLogP2.66
TPSA32.59 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.23
LogP ≤ 52.66
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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Related Compounds

(NE)-N-(2-ethylbutylidene)hydroxylamine
CID 5354129
N-(2-hexadecylnonadecylidene)hydroxylamine
CID 87129124
5-(hydroxyiminomethyl)nonan-2-ol
CID 170560071
3-ethylhept-1-ene
CID 12923943
1,1-dibromo-3-ethylhept-1-ene
CID 86711721
2-ethylhexanal;phosphane
CID 174518467
2-ethylhexanal;tantalum
CID 87424385
2-ethylhexanal;methane
CID 139299505
N-(2-methylundecylidene)hydroxylamine
CID 72729964
5-ethylnon-3-ene
CID 91177059
N-(4-ethyloctylidene)hydroxylamine
CID 174966103
(Z)-4-ethyl-2-methyloct-2-enoic acid
CID 5354816

Frequently Asked Questions

What is the IUPAC name of (NE)-N-(2-ethylhexylidene)hydroxylamine?
The IUPAC name of (NE)-N-(2-ethylhexylidene)hydroxylamine (CID 11252077) is (NE)-N-(2-ethylhexylidene)hydroxylamine.
What is the SMILES notation for (NE)-N-(2-ethylhexylidene)hydroxylamine?
The canonical SMILES for (NE)-N-(2-ethylhexylidene)hydroxylamine is CCCCC(/C=N/O)CC.
What is the InChIKey of (NE)-N-(2-ethylhexylidene)hydroxylamine?
The InChIKey is IYFCZUKVNNVJIJ-VQHVLOKHSA-N. The full InChI is InChI=1S/C8H17NO/c1-3-5-6-8(4-2)7-9-10/h7-8,10H,3-6H2,1-2H3/b9-7+.
What are the key properties of (NE)-N-(2-ethylhexylidene)hydroxylamine?
(NE)-N-(2-ethylhexylidene)hydroxylamine has a molecular weight of 143.23 g/mol, XLogP of 2.66, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (NE)-N-(2-ethylhexylidene)hydroxylamine is sourced from PubChem (CID 11252077), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).