6-hydroxy-N-propyloct-3-enamide

C11H21NO2 — CID 58183383

IUPAC6-hydroxy-N-propyloct-3-enamide
SMILESCCCNC(=O)CC=CCC(O)CC
InChIInChI=1S/C11H21NO2/c1-3-9-12-11(14)8-6-5-7-10(13)4-2/h5-6,10,13H,3-4,7-9H2,1-2H3,(H,12,14)
InChIKeyWXLIHWRBVVVOAL-UHFFFAOYSA-N
MW199.29 g/mol
LogP1.62
Rot. Bonds7

About 6-hydroxy-N-propyloct-3-enamide

6-hydroxy-N-propyloct-3-enamide (PubChem CID 58183383) has the molecular formula C11H21NO2 and a molecular weight of 199.29 g/mol. Its IUPAC name is 6-hydroxy-N-propyloct-3-enamide.

Molecular Properties

Compound Name6-hydroxy-N-propyloct-3-enamide
PubChem CID58183383
Molecular FormulaC11H21NO2
Molecular Weight199.29 g/mol
Exact Mass199.16
IUPAC Name6-hydroxy-N-propyloct-3-enamide
SMILESCCCNC(=O)CC=CCC(O)CC
InChIInChI=1S/C11H21NO2/c1-3-9-12-11(14)8-6-5-7-10(13)4-2/h5-6,10,13H,3-4,7-9H2,1-2H3,(H,12,14)
InChIKeyWXLIHWRBVVVOAL-UHFFFAOYSA-N
XLogP1.62
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.29
LogP ≤ 51.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 6-hydroxy-N-propyloct-3-enamide?
The IUPAC name of 6-hydroxy-N-propyloct-3-enamide (CID 58183383) is 6-hydroxy-N-propyloct-3-enamide.
What is the SMILES notation for 6-hydroxy-N-propyloct-3-enamide?
The canonical SMILES for 6-hydroxy-N-propyloct-3-enamide is CCCNC(=O)CC=CCC(O)CC.
What is the InChIKey of 6-hydroxy-N-propyloct-3-enamide?
The InChIKey is WXLIHWRBVVVOAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO2/c1-3-9-12-11(14)8-6-5-7-10(13)4-2/h5-6,10,13H,3-4,7-9H2,1-2H3,(H,12,14).
What are the key properties of 6-hydroxy-N-propyloct-3-enamide?
6-hydroxy-N-propyloct-3-enamide has a molecular weight of 199.29 g/mol, XLogP of 1.62, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-hydroxy-N-propyloct-3-enamide is sourced from PubChem (CID 58183383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).