9-(hydroxyamino)dec-9-en-2-one

C10H19NO2 — CID 143666602

IUPAC9-(hydroxyamino)dec-9-en-2-one
SMILESC=C(CCCCCCC(C)=O)NO
InChIInChI=1S/C10H19NO2/c1-9(11-13)7-5-3-4-6-8-10(2)12/h11,13H,1,3-8H2,2H3
InChIKeyQZDLUDKWMAJGJG-UHFFFAOYSA-N
MW185.27 g/mol
LogP2.41
Rot. Bonds8

About 9-(hydroxyamino)dec-9-en-2-one

9-(hydroxyamino)dec-9-en-2-one (PubChem CID 143666602) has the molecular formula C10H19NO2 and a molecular weight of 185.27 g/mol. Its IUPAC name is 9-(hydroxyamino)dec-9-en-2-one.

Molecular Properties

Compound Name9-(hydroxyamino)dec-9-en-2-one
PubChem CID143666602
Molecular FormulaC10H19NO2
Molecular Weight185.27 g/mol
Exact Mass185.14
IUPAC Name9-(hydroxyamino)dec-9-en-2-one
SMILESC=C(CCCCCCC(C)=O)NO
InChIInChI=1S/C10H19NO2/c1-9(11-13)7-5-3-4-6-8-10(2)12/h11,13H,1,3-8H2,2H3
InChIKeyQZDLUDKWMAJGJG-UHFFFAOYSA-N
XLogP2.41
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.27
LogP ≤ 52.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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

17-Aminooctadec-17-en-2-one
CID 88340112
2-Aminononadec-1-en-4-one
CID 88358530
18-Aminononadec-18-en-2-one
CID 88899705
7-(Hydroxyamino)oct-7-en-2-one
CID 143059142
10-Aminoundec-10-en-4-one
CID 146281540
N-hydroxy-8-(hydroxyamino)non-8-enamide
CID 172329467
3-[2-(Hydroxyamino)prop-2-enyl]heptan-2-one
CID 142070785

Frequently Asked Questions

What is the IUPAC name of 9-(hydroxyamino)dec-9-en-2-one?
The IUPAC name of 9-(hydroxyamino)dec-9-en-2-one (CID 143666602) is 9-(hydroxyamino)dec-9-en-2-one.
What is the SMILES notation for 9-(hydroxyamino)dec-9-en-2-one?
The canonical SMILES for 9-(hydroxyamino)dec-9-en-2-one is C=C(CCCCCCC(C)=O)NO.
What is the InChIKey of 9-(hydroxyamino)dec-9-en-2-one?
The InChIKey is QZDLUDKWMAJGJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO2/c1-9(11-13)7-5-3-4-6-8-10(2)12/h11,13H,1,3-8H2,2H3.
What are the key properties of 9-(hydroxyamino)dec-9-en-2-one?
9-(hydroxyamino)dec-9-en-2-one has a molecular weight of 185.27 g/mol, XLogP of 2.41, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(hydroxyamino)dec-9-en-2-one is sourced from PubChem (CID 143666602), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).