4-[(E)-1-phenylhex-1-enyl]morpholine

C16H23NO — CID 86278533

IUPAC4-[(E)-1-phenylhex-1-enyl]morpholine
SMILESCCCC/C=C(\c1ccccc1)N1CCOCC1
InChIInChI=1S/C16H23NO/c1-2-3-5-10-16(15-8-6-4-7-9-15)17-11-13-18-14-12-17/h4,6-10H,2-3,5,11-14H2,1H3/b16-10+
InChIKeyRTUURGCBPZPFMJ-MHWRWJLKSA-N
MW245.37 g/mol
LogP3.55
Rot. Bonds5

About 4-[(E)-1-phenylhex-1-enyl]morpholine

4-[(E)-1-phenylhex-1-enyl]morpholine (PubChem CID 86278533) has the molecular formula C16H23NO and a molecular weight of 245.37 g/mol. Its IUPAC name is 4-[(E)-1-phenylhex-1-enyl]morpholine.

Molecular Properties

Compound Name4-[(E)-1-phenylhex-1-enyl]morpholine
PubChem CID86278533
Molecular FormulaC16H23NO
Molecular Weight245.37 g/mol
Exact Mass245.18
IUPAC Name4-[(E)-1-phenylhex-1-enyl]morpholine
SMILESCCCC/C=C(\c1ccccc1)N1CCOCC1
InChIInChI=1S/C16H23NO/c1-2-3-5-10-16(15-8-6-4-7-9-15)17-11-13-18-14-12-17/h4,6-10H,2-3,5,11-14H2,1H3/b16-10+
InChIKeyRTUURGCBPZPFMJ-MHWRWJLKSA-N
XLogP3.55
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.37
LogP ≤ 53.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 4-[(E)-1-phenylhex-1-enyl]morpholine?
The IUPAC name of 4-[(E)-1-phenylhex-1-enyl]morpholine (CID 86278533) is 4-[(E)-1-phenylhex-1-enyl]morpholine.
What is the SMILES notation for 4-[(E)-1-phenylhex-1-enyl]morpholine?
The canonical SMILES for 4-[(E)-1-phenylhex-1-enyl]morpholine is CCCC/C=C(\c1ccccc1)N1CCOCC1.
What is the InChIKey of 4-[(E)-1-phenylhex-1-enyl]morpholine?
The InChIKey is RTUURGCBPZPFMJ-MHWRWJLKSA-N. The full InChI is InChI=1S/C16H23NO/c1-2-3-5-10-16(15-8-6-4-7-9-15)17-11-13-18-14-12-17/h4,6-10H,2-3,5,11-14H2,1H3/b16-10+.
What are the key properties of 4-[(E)-1-phenylhex-1-enyl]morpholine?
4-[(E)-1-phenylhex-1-enyl]morpholine has a molecular weight of 245.37 g/mol, XLogP of 3.55, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(E)-1-phenylhex-1-enyl]morpholine is sourced from PubChem (CID 86278533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).