N-(1-hydroxyiminooctan-2-ylidene)hydroxylamine

C8H16N2O2 — CID 141296672

IUPACN-(1-hydroxyiminooctan-2-ylidene)hydroxylamine
SMILESCCCCCCC(C=NO)=NO
InChIInChI=1S/C8H16N2O2/c1-2-3-4-5-6-8(10-12)7-9-11/h7,11-12H,2-6H2,1H3
InChIKeyARUFZEYVEXUYIP-UHFFFAOYSA-N
MW172.23 g/mol
LogP2.25
Rot. Bonds6

About N-(1-hydroxyiminooctan-2-ylidene)hydroxylamine

N-(1-hydroxyiminooctan-2-ylidene)hydroxylamine (PubChem CID 141296672) has the molecular formula C8H16N2O2 and a molecular weight of 172.23 g/mol. Its IUPAC name is N-(1-hydroxyiminooctan-2-ylidene)hydroxylamine.

Molecular Properties

Compound NameN-(1-hydroxyiminooctan-2-ylidene)hydroxylamine
PubChem CID141296672
Molecular FormulaC8H16N2O2
Molecular Weight172.23 g/mol
Exact Mass172.12
IUPAC NameN-(1-hydroxyiminooctan-2-ylidene)hydroxylamine
SMILESCCCCCCC(C=NO)=NO
InChIInChI=1S/C8H16N2O2/c1-2-3-4-5-6-8(10-12)7-9-11/h7,11-12H,2-6H2,1H3
InChIKeyARUFZEYVEXUYIP-UHFFFAOYSA-N
XLogP2.25
TPSA65.18 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.23
LogP ≤ 52.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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'}

Analyze N-(1-hydroxyiminooctan-2-ylidene)hydroxylamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-tridecan-2-ylidenehydroxylamine
CID 74054313
N-tetradecan-2-ylidenehydroxylamine
CID 140688122
(Z)-pentadec-2-en-3-ol
CID 141060609
N-nonadec-1-en-4-ylidenehydroxylamine
CID 174804170
N-methyldodec-2-en-4-imine
CID 123853785
(NZ)-N-[(2E)-2-hydroxyiminodecan-3-ylidene]hydroxylamine
CID 135992390
(NZ)-N-[(2E)-2-hydroxyiminoundecan-3-ylidene]hydroxylamine
CID 137128745
2-hydroxyiminoheptanoic acid
CID 134822061
(1Z)-N-hydroxyhexanimidoyl chloride
CID 13031985
(NE)-N-octylidenehydroxylamine
CID 5385260
N-nonan-4-ylidenehydroxylamine;hydrochloride
CID 86742675
9,10-dioctyloctadec-9-ene
CID 10814462

Frequently Asked Questions

What is the IUPAC name of N-(1-hydroxyiminooctan-2-ylidene)hydroxylamine?
The IUPAC name of N-(1-hydroxyiminooctan-2-ylidene)hydroxylamine (CID 141296672) is N-(1-hydroxyiminooctan-2-ylidene)hydroxylamine.
What is the SMILES notation for N-(1-hydroxyiminooctan-2-ylidene)hydroxylamine?
The canonical SMILES for N-(1-hydroxyiminooctan-2-ylidene)hydroxylamine is CCCCCCC(C=NO)=NO.
What is the InChIKey of N-(1-hydroxyiminooctan-2-ylidene)hydroxylamine?
The InChIKey is ARUFZEYVEXUYIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2O2/c1-2-3-4-5-6-8(10-12)7-9-11/h7,11-12H,2-6H2,1H3.
What are the key properties of N-(1-hydroxyiminooctan-2-ylidene)hydroxylamine?
N-(1-hydroxyiminooctan-2-ylidene)hydroxylamine has a molecular weight of 172.23 g/mol, XLogP of 2.25, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-hydroxyiminooctan-2-ylidene)hydroxylamine is sourced from PubChem (CID 141296672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).