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

C12H23NO — CID 10465317

IUPAC4-[(E)-oct-1-enyl]morpholine
SMILESCCCCCC/C=C/N1CCOCC1
InChIInChI=1S/C12H23NO/c1-2-3-4-5-6-7-8-13-9-11-14-12-10-13/h7-8H,2-6,9-12H2,1H3/b8-7+
InChIKeyDMWHBJKPNPVVMN-BQYQJAHWSA-N
MW197.32 g/mol
LogP2.80
Rot. Bonds6

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

4-[(E)-oct-1-enyl]morpholine (PubChem CID 10465317) has the molecular formula C12H23NO and a molecular weight of 197.32 g/mol. Its IUPAC name is 4-[(E)-oct-1-enyl]morpholine.

Molecular Properties

Compound Name4-[(E)-oct-1-enyl]morpholine
PubChem CID10465317
Molecular FormulaC12H23NO
Molecular Weight197.32 g/mol
Exact Mass197.18
IUPAC Name4-[(E)-oct-1-enyl]morpholine
SMILESCCCCCC/C=C/N1CCOCC1
InChIInChI=1S/C12H23NO/c1-2-3-4-5-6-7-8-13-9-11-14-12-10-13/h7-8H,2-6,9-12H2,1H3/b8-7+
InChIKeyDMWHBJKPNPVVMN-BQYQJAHWSA-N
XLogP2.80
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.32
LogP ≤ 52.80
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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Related Compounds

Morpholine, 4-(1-butenyl)-
CID 641552
Morpholine, 4-(3-methyl-1-butenyl)-
CID 6452899
4-[(1E)-1-hexenyl]morpholine
CID 10103565
4-[(Z)-but-1-enyl]morpholine
CID 11008007
4-[(E)-hept-1-enyl]morpholine
CID 15619040
N-octadienylmorpholine
CID 23467545
1-Morpholino-1-octene
CID 53768338
4-(Hex-1-en-1-yl)morpholine
CID 53971130
2-Methyl-1-morpholino-1-pentene
CID 85679855
Pentenylmorpholine
CID 129814081
4-[(E)-pent-1-enyl]morpholine
CID 10080607
4-[(E)-4-methylpent-1-enyl]morpholine
CID 12509072

Frequently Asked Questions

What is the IUPAC name of 4-[(E)-oct-1-enyl]morpholine?
The IUPAC name of 4-[(E)-oct-1-enyl]morpholine (CID 10465317) is 4-[(E)-oct-1-enyl]morpholine.
What is the SMILES notation for 4-[(E)-oct-1-enyl]morpholine?
The canonical SMILES for 4-[(E)-oct-1-enyl]morpholine is CCCCCC/C=C/N1CCOCC1.
What is the InChIKey of 4-[(E)-oct-1-enyl]morpholine?
The InChIKey is DMWHBJKPNPVVMN-BQYQJAHWSA-N. The full InChI is InChI=1S/C12H23NO/c1-2-3-4-5-6-7-8-13-9-11-14-12-10-13/h7-8H,2-6,9-12H2,1H3/b8-7+.
What are the key properties of 4-[(E)-oct-1-enyl]morpholine?
4-[(E)-oct-1-enyl]morpholine has a molecular weight of 197.32 g/mol, XLogP of 2.80, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(E)-oct-1-enyl]morpholine is sourced from PubChem (CID 10465317), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).