4-ethenyl-3-morpholin-4-ylocta-4,6-dien-1-amine

C14H24N2O — CID 91378889

IUPAC4-ethenyl-3-morpholin-4-ylocta-4,6-dien-1-amine
SMILESC=CC(=CC=CC)C(CCN)N1CCOCC1
InChIInChI=1S/C14H24N2O/c1-3-5-6-13(4-2)14(7-8-15)16-9-11-17-12-10-16/h3-6,14H,2,7-12,15H2,1H3
InChIKeyUHYNBYWLGPCOEB-UHFFFAOYSA-N
MW236.36 g/mol
LogP1.72
Rot. Bonds6

About 4-ethenyl-3-morpholin-4-ylocta-4,6-dien-1-amine

4-ethenyl-3-morpholin-4-ylocta-4,6-dien-1-amine (PubChem CID 91378889) has the molecular formula C14H24N2O and a molecular weight of 236.36 g/mol. Its IUPAC name is 4-ethenyl-3-morpholin-4-ylocta-4,6-dien-1-amine.

Molecular Properties

Compound Name4-ethenyl-3-morpholin-4-ylocta-4,6-dien-1-amine
PubChem CID91378889
Molecular FormulaC14H24N2O
Molecular Weight236.36 g/mol
Exact Mass236.19
IUPAC Name4-ethenyl-3-morpholin-4-ylocta-4,6-dien-1-amine
SMILESC=CC(=CC=CC)C(CCN)N1CCOCC1
InChIInChI=1S/C14H24N2O/c1-3-5-6-13(4-2)14(7-8-15)16-9-11-17-12-10-16/h3-6,14H,2,7-12,15H2,1H3
InChIKeyUHYNBYWLGPCOEB-UHFFFAOYSA-N
XLogP1.72
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.36
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 4-ethenyl-3-morpholin-4-ylocta-4,6-dien-1-amine?
The IUPAC name of 4-ethenyl-3-morpholin-4-ylocta-4,6-dien-1-amine (CID 91378889) is 4-ethenyl-3-morpholin-4-ylocta-4,6-dien-1-amine.
What is the SMILES notation for 4-ethenyl-3-morpholin-4-ylocta-4,6-dien-1-amine?
The canonical SMILES for 4-ethenyl-3-morpholin-4-ylocta-4,6-dien-1-amine is C=CC(=CC=CC)C(CCN)N1CCOCC1.
What is the InChIKey of 4-ethenyl-3-morpholin-4-ylocta-4,6-dien-1-amine?
The InChIKey is UHYNBYWLGPCOEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O/c1-3-5-6-13(4-2)14(7-8-15)16-9-11-17-12-10-16/h3-6,14H,2,7-12,15H2,1H3.
What are the key properties of 4-ethenyl-3-morpholin-4-ylocta-4,6-dien-1-amine?
4-ethenyl-3-morpholin-4-ylocta-4,6-dien-1-amine has a molecular weight of 236.36 g/mol, XLogP of 1.72, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethenyl-3-morpholin-4-ylocta-4,6-dien-1-amine is sourced from PubChem (CID 91378889), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).