4-propa-1,2-dienylmorpholine

C7H11NO — CID 12721261

IUPAC4-propa-1,2-dienylmorpholine
SMILESC=C=CN1CCOCC1
InChIInChI=1S/C7H11NO/c1-2-3-8-4-6-9-7-5-8/h3H,1,4-7H2
InChIKeyRVCYUNBNODFKIO-UHFFFAOYSA-N
MW125.17 g/mol
LogP0.62
Rot. Bonds1

About 4-propa-1,2-dienylmorpholine

4-propa-1,2-dienylmorpholine (PubChem CID 12721261) has the molecular formula C7H11NO and a molecular weight of 125.17 g/mol. Its IUPAC name is 4-propa-1,2-dienylmorpholine.

Molecular Properties

Compound Name4-propa-1,2-dienylmorpholine
PubChem CID12721261
Molecular FormulaC7H11NO
Molecular Weight125.17 g/mol
Exact Mass125.08
IUPAC Name4-propa-1,2-dienylmorpholine
SMILESC=C=CN1CCOCC1
InChIInChI=1S/C7H11NO/c1-2-3-8-4-6-9-7-5-8/h3H,1,4-7H2
InChIKeyRVCYUNBNODFKIO-UHFFFAOYSA-N
XLogP0.62
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500125.17
LogP ≤ 50.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

Morpholine, 4-(2-methyl-1-propenyl)-
CID 102255
4-[(1Z)-prop-1-en-1-yl]morpholine
CID 643773
1-Morpolino-2,3-butadiene
CID 567704
morpholine, 4-[(1E)-1-propenyl]-
CID 637918
1-Morpholino-1,3-butadiene
CID 5372462
4-Ethenylmorpholine
CID 9812766
4-(Buta-1,3-dien-1-yl)morpholine
CID 586981
4-Prop-1-en-2-ylmorpholine
CID 12570654
4-[(Z)-2-fluoroprop-1-enyl]morpholine
CID 89774522
4-[(Z)-2,3,3,3-tetrafluoroprop-1-enyl]morpholine
CID 102316233
4-[(E)-1-fluoroprop-1-enyl]morpholine
CID 129271759
4-[(Z)-1-fluoroprop-1-enyl]morpholine
CID 154949122

Frequently Asked Questions

What is the IUPAC name of 4-propa-1,2-dienylmorpholine?
The IUPAC name of 4-propa-1,2-dienylmorpholine (CID 12721261) is 4-propa-1,2-dienylmorpholine.
What is the SMILES notation for 4-propa-1,2-dienylmorpholine?
The canonical SMILES for 4-propa-1,2-dienylmorpholine is C=C=CN1CCOCC1.
What is the InChIKey of 4-propa-1,2-dienylmorpholine?
The InChIKey is RVCYUNBNODFKIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11NO/c1-2-3-8-4-6-9-7-5-8/h3H,1,4-7H2.
What are the key properties of 4-propa-1,2-dienylmorpholine?
4-propa-1,2-dienylmorpholine has a molecular weight of 125.17 g/mol, XLogP of 0.62, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-propa-1,2-dienylmorpholine is sourced from PubChem (CID 12721261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).