(E)-4-methyl-1-morpholin-4-ylhex-4-en-1-one

C11H19NO2 — CID 11367613

IUPAC(E)-4-methyl-1-morpholin-4-ylhex-4-en-1-one
SMILESC/C=C(\C)CCC(=O)N1CCOCC1
InChIInChI=1S/C11H19NO2/c1-3-10(2)4-5-11(13)12-6-8-14-9-7-12/h3H,4-9H2,1-2H3/b10-3+
InChIKeyRIUJLEKKPFBBGB-XCVCLJGOSA-N
MW197.28 g/mol
LogP1.59
Rot. Bonds3

About (E)-4-methyl-1-morpholin-4-ylhex-4-en-1-one

(E)-4-methyl-1-morpholin-4-ylhex-4-en-1-one (PubChem CID 11367613) has the molecular formula C11H19NO2 and a molecular weight of 197.28 g/mol. Its IUPAC name is (E)-4-methyl-1-morpholin-4-ylhex-4-en-1-one.

Molecular Properties

Compound Name(E)-4-methyl-1-morpholin-4-ylhex-4-en-1-one
PubChem CID11367613
Molecular FormulaC11H19NO2
Molecular Weight197.28 g/mol
Exact Mass197.14
IUPAC Name(E)-4-methyl-1-morpholin-4-ylhex-4-en-1-one
SMILESC/C=C(\C)CCC(=O)N1CCOCC1
InChIInChI=1S/C11H19NO2/c1-3-10(2)4-5-11(13)12-6-8-14-9-7-12/h3H,4-9H2,1-2H3/b10-3+
InChIKeyRIUJLEKKPFBBGB-XCVCLJGOSA-N
XLogP1.59
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.28
LogP ≤ 51.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

Arachidonoylmorpholine
CID 5283433
Oleoylmorpholine
CID 6437597
(4Z,7Z,10Z,13Z,16Z,19Z)-1-morpholin-4-yldocosa-4,7,10,13,16,19-hexaen-1-one
CID 90071172
2,2-Difluoro-4-methyl-1-morpholinopent-4-en-1-one
CID 168720309
Cyclohex-3-en-1-yl(morpholino)methanone
CID 12760863
(E)-4-ethyl-2,2-difluoro-1-morpholinohex-4-en-1-one
CID 168720313
1-Morpholin-4-yloctadec-9-en-1-one
CID 111060
Linoleoylmorpholine
CID 10948080
Cyclopenten-1-yl(morpholin-4-yl)methanone
CID 12211171
1-Morpholin-4-ylhept-6-en-1-one
CID 19855845
Cyclopenten-1-yl-(3,3-dimethylmorpholin-4-yl)methanone
CID 84588579
Cyclohexen-1-yl(morpholin-4-yl)methanone
CID 12184550

Frequently Asked Questions

What is the IUPAC name of (E)-4-methyl-1-morpholin-4-ylhex-4-en-1-one?
The IUPAC name of (E)-4-methyl-1-morpholin-4-ylhex-4-en-1-one (CID 11367613) is (E)-4-methyl-1-morpholin-4-ylhex-4-en-1-one.
What is the SMILES notation for (E)-4-methyl-1-morpholin-4-ylhex-4-en-1-one?
The canonical SMILES for (E)-4-methyl-1-morpholin-4-ylhex-4-en-1-one is C/C=C(\C)CCC(=O)N1CCOCC1.
What is the InChIKey of (E)-4-methyl-1-morpholin-4-ylhex-4-en-1-one?
The InChIKey is RIUJLEKKPFBBGB-XCVCLJGOSA-N. The full InChI is InChI=1S/C11H19NO2/c1-3-10(2)4-5-11(13)12-6-8-14-9-7-12/h3H,4-9H2,1-2H3/b10-3+.
What are the key properties of (E)-4-methyl-1-morpholin-4-ylhex-4-en-1-one?
(E)-4-methyl-1-morpholin-4-ylhex-4-en-1-one has a molecular weight of 197.28 g/mol, XLogP of 1.59, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-4-methyl-1-morpholin-4-ylhex-4-en-1-one is sourced from PubChem (CID 11367613), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).