(Z)-4-(Octadec-9-en-1-yl)morpholine

C22H43NO — CID 13947581

IUPAC4-[(Z)-octadec-9-enyl]morpholine
SMILESCCCCCCCC/C=C\CCCCCCCCN1CCOCC1
InChIInChI=1S/C22H43NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-23-19-21-24-22-20-23/h9-10H,2-8,11-22H2,1H3/b10-9-
InChIKeyOSNVKHBQAYVRFA-KTKRTIGZSA-N
MW337.60 g/mol
LogP7.80
Rot. Bonds16

About (Z)-4-(Octadec-9-en-1-yl)morpholine

(Z)-4-(Octadec-9-en-1-yl)morpholine (PubChem CID 13947581) has the molecular formula C22H43NO and a molecular weight of 337.60 g/mol. Its IUPAC name is 4-[(Z)-octadec-9-enyl]morpholine.

Molecular Properties

Compound Name(Z)-4-(Octadec-9-en-1-yl)morpholine
PubChem CID13947581
Molecular FormulaC22H43NO
Molecular Weight337.60 g/mol
Exact Mass337.33
IUPAC Name4-[(Z)-octadec-9-enyl]morpholine
SMILESCCCCCCCC/C=C\CCCCCCCCN1CCOCC1
InChIInChI=1S/C22H43NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-23-19-21-24-22-20-23/h9-10H,2-8,11-22H2,1H3/b10-9-
InChIKeyOSNVKHBQAYVRFA-KTKRTIGZSA-N
XLogP7.80
TPSA12.50 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds16
Heavy Atoms24
Complexity271

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500337.60
LogP ≤ 57.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze (Z)-4-(Octadec-9-en-1-yl)morpholine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (Z)-4-(Octadec-9-en-1-yl)morpholine?
The IUPAC name of (Z)-4-(Octadec-9-en-1-yl)morpholine (CID 13947581) is 4-[(Z)-octadec-9-enyl]morpholine.
What is the SMILES notation for (Z)-4-(Octadec-9-en-1-yl)morpholine?
The canonical SMILES for (Z)-4-(Octadec-9-en-1-yl)morpholine is CCCCCCCC/C=C\CCCCCCCCN1CCOCC1.
What is the InChIKey of (Z)-4-(Octadec-9-en-1-yl)morpholine?
The InChIKey is OSNVKHBQAYVRFA-KTKRTIGZSA-N. The full InChI is InChI=1S/C22H43NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-23-19-21-24-22-20-23/h9-10H,2-8,11-22H2,1H3/b10-9-.
What are the key properties of (Z)-4-(Octadec-9-en-1-yl)morpholine?
(Z)-4-(Octadec-9-en-1-yl)morpholine has a molecular weight of 337.60 g/mol, XLogP of 7.80, 16 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-4-(Octadec-9-en-1-yl)morpholine is sourced from PubChem (CID 13947581), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).