4-[(Z)-4-[[(Z)-but-2-en-2-yl]iminomethyl]hex-4-enyl]morpholin-3-one

C15H24N2O2 — CID 134406169

IUPAC4-[(Z)-4-[[(Z)-but-2-en-2-yl]iminomethyl]hex-4-enyl]morpholin-3-one
SMILESC/C=C(\C=N\C(C)=C/C)CCCN1CCOCC1=O
InChIInChI=1S/C15H24N2O2/c1-4-13(3)16-11-14(5-2)7-6-8-17-9-10-19-12-15(17)18/h4-5,11H,6-10,12H2,1-3H3/b13-4-,14-5-,16-11+
InChIKeyIOAOIFISMZJZQI-NFBCRSCBSA-N
MW264.37 g/mol
LogP2.57
Rot. Bonds6

About 4-[(Z)-4-[[(Z)-but-2-en-2-yl]iminomethyl]hex-4-enyl]morpholin-3-one

4-[(Z)-4-[[(Z)-but-2-en-2-yl]iminomethyl]hex-4-enyl]morpholin-3-one (PubChem CID 134406169) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is 4-[(Z)-4-[[(Z)-but-2-en-2-yl]iminomethyl]hex-4-enyl]morpholin-3-one.

Molecular Properties

Compound Name4-[(Z)-4-[[(Z)-but-2-en-2-yl]iminomethyl]hex-4-enyl]morpholin-3-one
PubChem CID134406169
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC Name4-[(Z)-4-[[(Z)-but-2-en-2-yl]iminomethyl]hex-4-enyl]morpholin-3-one
SMILESC/C=C(\C=N\C(C)=C/C)CCCN1CCOCC1=O
InChIInChI=1S/C15H24N2O2/c1-4-13(3)16-11-14(5-2)7-6-8-17-9-10-19-12-15(17)18/h4-5,11H,6-10,12H2,1-3H3/b13-4-,14-5-,16-11+
InChIKeyIOAOIFISMZJZQI-NFBCRSCBSA-N
XLogP2.57
TPSA41.90 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 52.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 4-[(Z)-4-[[(Z)-but-2-en-2-yl]iminomethyl]hex-4-enyl]morpholin-3-one?
The IUPAC name of 4-[(Z)-4-[[(Z)-but-2-en-2-yl]iminomethyl]hex-4-enyl]morpholin-3-one (CID 134406169) is 4-[(Z)-4-[[(Z)-but-2-en-2-yl]iminomethyl]hex-4-enyl]morpholin-3-one.
What is the SMILES notation for 4-[(Z)-4-[[(Z)-but-2-en-2-yl]iminomethyl]hex-4-enyl]morpholin-3-one?
The canonical SMILES for 4-[(Z)-4-[[(Z)-but-2-en-2-yl]iminomethyl]hex-4-enyl]morpholin-3-one is C/C=C(\C=N\C(C)=C/C)CCCN1CCOCC1=O.
What is the InChIKey of 4-[(Z)-4-[[(Z)-but-2-en-2-yl]iminomethyl]hex-4-enyl]morpholin-3-one?
The InChIKey is IOAOIFISMZJZQI-NFBCRSCBSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-4-13(3)16-11-14(5-2)7-6-8-17-9-10-19-12-15(17)18/h4-5,11H,6-10,12H2,1-3H3/b13-4-,14-5-,16-11+.
What are the key properties of 4-[(Z)-4-[[(Z)-but-2-en-2-yl]iminomethyl]hex-4-enyl]morpholin-3-one?
4-[(Z)-4-[[(Z)-but-2-en-2-yl]iminomethyl]hex-4-enyl]morpholin-3-one has a molecular weight of 264.37 g/mol, XLogP of 2.57, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(Z)-4-[[(Z)-but-2-en-2-yl]iminomethyl]hex-4-enyl]morpholin-3-one is sourced from PubChem (CID 134406169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).