1-[(Z)-4-[(Z)-2-(methylideneamino)ethenyl]hex-4-enyl]piperidine-2,6-dione

C14H20N2O2 — CID 154469852

IUPAC1-[(Z)-4-[(Z)-2-(methylideneamino)ethenyl]hex-4-enyl]piperidine-2,6-dione
SMILESC=N/C=C\C(=C/C)CCCN1C(=O)CCCC1=O
InChIInChI=1S/C14H20N2O2/c1-3-12(9-10-15-2)6-5-11-16-13(17)7-4-8-14(16)18/h3,9-10H,2,4-8,11H2,1H3/b10-9-,12-3-
InChIKeyLQFXKSAZJPSGFI-ZSWLAKRQSA-N
MW248.33 g/mol
LogP2.47
Rot. Bonds6

About 1-[(Z)-4-[(Z)-2-(methylideneamino)ethenyl]hex-4-enyl]piperidine-2,6-dione

1-[(Z)-4-[(Z)-2-(methylideneamino)ethenyl]hex-4-enyl]piperidine-2,6-dione (PubChem CID 154469852) has the molecular formula C14H20N2O2 and a molecular weight of 248.33 g/mol. Its IUPAC name is 1-[(Z)-4-[(Z)-2-(methylideneamino)ethenyl]hex-4-enyl]piperidine-2,6-dione.

Molecular Properties

Compound Name1-[(Z)-4-[(Z)-2-(methylideneamino)ethenyl]hex-4-enyl]piperidine-2,6-dione
PubChem CID154469852
Molecular FormulaC14H20N2O2
Molecular Weight248.33 g/mol
Exact Mass248.15
IUPAC Name1-[(Z)-4-[(Z)-2-(methylideneamino)ethenyl]hex-4-enyl]piperidine-2,6-dione
SMILESC=N/C=C\C(=C/C)CCCN1C(=O)CCCC1=O
InChIInChI=1S/C14H20N2O2/c1-3-12(9-10-15-2)6-5-11-16-13(17)7-4-8-14(16)18/h3,9-10H,2,4-8,11H2,1H3/b10-9-,12-3-
InChIKeyLQFXKSAZJPSGFI-ZSWLAKRQSA-N
XLogP2.47
TPSA49.74 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 52.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 1-[(Z)-4-[(Z)-2-(methylideneamino)ethenyl]hex-4-enyl]piperidine-2,6-dione with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-undecylpiperidine-2,6-dione
CID 91705281
1-(4-aminobutyl)piperidine-2,6-dione
CID 43447549
1-(4-iodobutyl)azepane-2,7-dione
CID 139913177
N-butyl-4-(2,5-dioxopyrrolidin-1-yl)butanamide
CID 17035020
1-(3-azidopropyl)piperidine-2,6-dione
CID 61396596
N-cyclohexyl-4-(2,5-dioxopyrrolidin-1-yl)butanamide
CID 17034995
N-amino-N'-[3-(2,6-dioxopiperidin-1-yl)propyl]methanimidamide
CID 155198914
1-[3-(propan-2-ylamino)propyl]piperidine-2,6-dione
CID 61387967
6-hydroxy-1-[(Z,3Z)-3-[(methylideneamino)methylidene]hex-4-enyl]piperidin-2-one
CID 155198881
4-(2,5-dioxopyrrolidin-1-yl)-N-[2-[hydroxy(methyl)amino]ethyl]butanamide
CID 165403538
N-[2-(2,6-dioxopiperidin-1-yl)ethyl]-N'-methyl-N-(methylideneamino)methanimidamide
CID 123913713
1-(3-aminopropyl)azepane-2,7-dione
CID 43447536

Frequently Asked Questions

What is the IUPAC name of 1-[(Z)-4-[(Z)-2-(methylideneamino)ethenyl]hex-4-enyl]piperidine-2,6-dione?
The IUPAC name of 1-[(Z)-4-[(Z)-2-(methylideneamino)ethenyl]hex-4-enyl]piperidine-2,6-dione (CID 154469852) is 1-[(Z)-4-[(Z)-2-(methylideneamino)ethenyl]hex-4-enyl]piperidine-2,6-dione.
What is the SMILES notation for 1-[(Z)-4-[(Z)-2-(methylideneamino)ethenyl]hex-4-enyl]piperidine-2,6-dione?
The canonical SMILES for 1-[(Z)-4-[(Z)-2-(methylideneamino)ethenyl]hex-4-enyl]piperidine-2,6-dione is C=N/C=C\C(=C/C)CCCN1C(=O)CCCC1=O.
What is the InChIKey of 1-[(Z)-4-[(Z)-2-(methylideneamino)ethenyl]hex-4-enyl]piperidine-2,6-dione?
The InChIKey is LQFXKSAZJPSGFI-ZSWLAKRQSA-N. The full InChI is InChI=1S/C14H20N2O2/c1-3-12(9-10-15-2)6-5-11-16-13(17)7-4-8-14(16)18/h3,9-10H,2,4-8,11H2,1H3/b10-9-,12-3-.
What are the key properties of 1-[(Z)-4-[(Z)-2-(methylideneamino)ethenyl]hex-4-enyl]piperidine-2,6-dione?
1-[(Z)-4-[(Z)-2-(methylideneamino)ethenyl]hex-4-enyl]piperidine-2,6-dione has a molecular weight of 248.33 g/mol, XLogP of 2.47, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(Z)-4-[(Z)-2-(methylideneamino)ethenyl]hex-4-enyl]piperidine-2,6-dione is sourced from PubChem (CID 154469852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).