3-(5-methylundeca-3,4-dienoyl)-1,3-oxazolidin-2-one

C15H23NO3 — CID 102288208

IUPAC3-(5-methylundeca-3,4-dienoyl)-1,3-oxazolidin-2-one
SMILESCCCCCCC(C)=C=CCC(=O)N1CCOC1=O
InChIInChI=1S/C15H23NO3/c1-3-4-5-6-8-13(2)9-7-10-14(17)16-11-12-19-15(16)18/h7H,3-6,8,10-12H2,1-2H3
InChIKeyQKVHZXYMYNHFNO-UHFFFAOYSA-N
MW265.35 g/mol
LogP3.43
Rot. Bonds7

About 3-(5-methylundeca-3,4-dienoyl)-1,3-oxazolidin-2-one

3-(5-methylundeca-3,4-dienoyl)-1,3-oxazolidin-2-one (PubChem CID 102288208) has the molecular formula C15H23NO3 and a molecular weight of 265.35 g/mol. Its IUPAC name is 3-(5-methylundeca-3,4-dienoyl)-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name3-(5-methylundeca-3,4-dienoyl)-1,3-oxazolidin-2-one
PubChem CID102288208
Molecular FormulaC15H23NO3
Molecular Weight265.35 g/mol
Exact Mass265.17
IUPAC Name3-(5-methylundeca-3,4-dienoyl)-1,3-oxazolidin-2-one
SMILESCCCCCCC(C)=C=CCC(=O)N1CCOC1=O
InChIInChI=1S/C15H23NO3/c1-3-4-5-6-8-13(2)9-7-10-14(17)16-11-12-19-15(16)18/h7H,3-6,8,10-12H2,1-2H3
InChIKeyQKVHZXYMYNHFNO-UHFFFAOYSA-N
XLogP3.43
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.35
LogP ≤ 53.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

3-octadecyl-1,3-oxazolidin-2-one
CID 59720965
3-octyl-1,3-oxazolidin-2-one
CID 3565999
1-(2-oxo-1,3-oxazolidin-3-yl)hexane-1,3-dione
CID 25146758
3-non-8-enoyl-1,3-oxazolidin-2-one
CID 89302555
3-[(E)-hex-4-enoyl]-1,3-oxazolidin-2-one
CID 15502915
3-(3-butylsulfanylbutanoyl)-1,3-oxazolidin-2-one
CID 11265081
1-(2-sulfanylidene-1,3-oxazinan-3-yl)dodecan-1-one
CID 18702563
5-methylundeca-3,4-dien-1-ol
CID 71664600
3-(3-ethylpentanoyl)-1,3-oxazolidin-2-one
CID 15521538
3-(3-methylbutanoyl)-1,3-oxazolidin-2-one
CID 10352137
methyl 4-oxo-4-(2-oxo-1,3-oxazolidin-3-yl)butanoate
CID 12032170
3-[(3R)-3-sulfanylhexanoyl]-1,3-oxazolidin-2-one
CID 102035689

Frequently Asked Questions

What is the IUPAC name of 3-(5-methylundeca-3,4-dienoyl)-1,3-oxazolidin-2-one?
The IUPAC name of 3-(5-methylundeca-3,4-dienoyl)-1,3-oxazolidin-2-one (CID 102288208) is 3-(5-methylundeca-3,4-dienoyl)-1,3-oxazolidin-2-one.
What is the SMILES notation for 3-(5-methylundeca-3,4-dienoyl)-1,3-oxazolidin-2-one?
The canonical SMILES for 3-(5-methylundeca-3,4-dienoyl)-1,3-oxazolidin-2-one is CCCCCCC(C)=C=CCC(=O)N1CCOC1=O.
What is the InChIKey of 3-(5-methylundeca-3,4-dienoyl)-1,3-oxazolidin-2-one?
The InChIKey is QKVHZXYMYNHFNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO3/c1-3-4-5-6-8-13(2)9-7-10-14(17)16-11-12-19-15(16)18/h7H,3-6,8,10-12H2,1-2H3.
What are the key properties of 3-(5-methylundeca-3,4-dienoyl)-1,3-oxazolidin-2-one?
3-(5-methylundeca-3,4-dienoyl)-1,3-oxazolidin-2-one has a molecular weight of 265.35 g/mol, XLogP of 3.43, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-methylundeca-3,4-dienoyl)-1,3-oxazolidin-2-one is sourced from PubChem (CID 102288208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).