N,N-diethylhydroxylamine;N-octylhydroxylamine

C12H30N2O2 — CID 88620060

IUPACN,N-diethylhydroxylamine;N-octylhydroxylamine
SMILESCCCCCCCCNO.CCN(O)CC
InChIInChI=1S/C8H19NO.C4H11NO/c1-2-3-4-5-6-7-8-9-10;1-3-5(6)4-2/h9-10H,2-8H2,1H3;6H,3-4H2,1-2H3
InChIKeyLNHFXWVDHAINIL-UHFFFAOYSA-N
MW234.38 g/mol
LogP3.04
Rot. Bonds9

About N,N-diethylhydroxylamine;N-octylhydroxylamine

N,N-diethylhydroxylamine;N-octylhydroxylamine (PubChem CID 88620060) has the molecular formula C12H30N2O2 and a molecular weight of 234.38 g/mol. Its IUPAC name is N,N-diethylhydroxylamine;N-octylhydroxylamine.

Molecular Properties

Compound NameN,N-diethylhydroxylamine;N-octylhydroxylamine
PubChem CID88620060
Molecular FormulaC12H30N2O2
Molecular Weight234.38 g/mol
Exact Mass234.23
IUPAC NameN,N-diethylhydroxylamine;N-octylhydroxylamine
SMILESCCCCCCCCNO.CCN(O)CC
InChIInChI=1S/C8H19NO.C4H11NO/c1-2-3-4-5-6-7-8-9-10;1-3-5(6)4-2/h9-10H,2-8H2,1H3;6H,3-4H2,1-2H3
InChIKeyLNHFXWVDHAINIL-UHFFFAOYSA-N
XLogP3.04
TPSA55.73 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.38
LogP ≤ 53.04
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

ethane;N-hexylhydroxylamine
CID 23139656
azane;N-hexylhydroxylamine;molecular hydrogen
CID 162388003
N-[(Z)-octadec-9-enyl]hydroxylamine
CID 87125672
N-decyl-N-dodecylhydroxylamine
CID 151707485
N,N-di(heptadecyl)hydroxylamine
CID 71426964
N-[5-(3-butyloxiran-2-yl)pentyl]hydroxylamine
CID 167175318
hexadecane;N-[2-(hydroxyamino)ethyl]-N-oct-7-enylhydroxylamine;molecular hydrogen;octan-1-ol
CID 168924421
N-hexyltridecan-1-amine
CID 87659278
1,2-diheptylhydrazine
CID 11195547
1-decyl-2-octylhydrazine
CID 154085192
octane;N-octylnonan-1-amine
CID 145152206
N-undecyltetradecan-1-amine
CID 166059375

Frequently Asked Questions

What is the IUPAC name of N,N-diethylhydroxylamine;N-octylhydroxylamine?
The IUPAC name of N,N-diethylhydroxylamine;N-octylhydroxylamine (CID 88620060) is N,N-diethylhydroxylamine;N-octylhydroxylamine.
What is the SMILES notation for N,N-diethylhydroxylamine;N-octylhydroxylamine?
The canonical SMILES for N,N-diethylhydroxylamine;N-octylhydroxylamine is CCCCCCCCNO.CCN(O)CC.
What is the InChIKey of N,N-diethylhydroxylamine;N-octylhydroxylamine?
The InChIKey is LNHFXWVDHAINIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19NO.C4H11NO/c1-2-3-4-5-6-7-8-9-10;1-3-5(6)4-2/h9-10H,2-8H2,1H3;6H,3-4H2,1-2H3.
What are the key properties of N,N-diethylhydroxylamine;N-octylhydroxylamine?
N,N-diethylhydroxylamine;N-octylhydroxylamine has a molecular weight of 234.38 g/mol, XLogP of 3.04, 9 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethylhydroxylamine;N-octylhydroxylamine is sourced from PubChem (CID 88620060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).