2-morpholin-4-ylundec-2-en-6-one

C15H27NO2 — CID 57160366

IUPAC2-morpholin-4-ylundec-2-en-6-one
SMILESCCCCCC(=O)CCC=C(C)N1CCOCC1
InChIInChI=1S/C15H27NO2/c1-3-4-5-8-15(17)9-6-7-14(2)16-10-12-18-13-11-16/h7H,3-6,8-13H2,1-2H3
InChIKeyXJHKMGJLPMIGRO-UHFFFAOYSA-N
MW253.39 g/mol
LogP3.15
Rot. Bonds8

About 2-morpholin-4-ylundec-2-en-6-one

2-morpholin-4-ylundec-2-en-6-one (PubChem CID 57160366) has the molecular formula C15H27NO2 and a molecular weight of 253.39 g/mol. Its IUPAC name is 2-morpholin-4-ylundec-2-en-6-one.

Molecular Properties

Compound Name2-morpholin-4-ylundec-2-en-6-one
PubChem CID57160366
Molecular FormulaC15H27NO2
Molecular Weight253.39 g/mol
Exact Mass253.20
IUPAC Name2-morpholin-4-ylundec-2-en-6-one
SMILESCCCCCC(=O)CCC=C(C)N1CCOCC1
InChIInChI=1S/C15H27NO2/c1-3-4-5-8-15(17)9-6-7-14(2)16-10-12-18-13-11-16/h7H,3-6,8-13H2,1-2H3
InChIKeyXJHKMGJLPMIGRO-UHFFFAOYSA-N
XLogP3.15
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.39
LogP ≤ 53.15
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

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Frequently Asked Questions

What is the IUPAC name of 2-morpholin-4-ylundec-2-en-6-one?
The IUPAC name of 2-morpholin-4-ylundec-2-en-6-one (CID 57160366) is 2-morpholin-4-ylundec-2-en-6-one.
What is the SMILES notation for 2-morpholin-4-ylundec-2-en-6-one?
The canonical SMILES for 2-morpholin-4-ylundec-2-en-6-one is CCCCCC(=O)CCC=C(C)N1CCOCC1.
What is the InChIKey of 2-morpholin-4-ylundec-2-en-6-one?
The InChIKey is XJHKMGJLPMIGRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27NO2/c1-3-4-5-8-15(17)9-6-7-14(2)16-10-12-18-13-11-16/h7H,3-6,8-13H2,1-2H3.
What are the key properties of 2-morpholin-4-ylundec-2-en-6-one?
2-morpholin-4-ylundec-2-en-6-one has a molecular weight of 253.39 g/mol, XLogP of 3.15, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-morpholin-4-ylundec-2-en-6-one is sourced from PubChem (CID 57160366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).