2-prop-2-enylmorpholine

C7H13NO — CID 20536842

IUPAC2-prop-2-enylmorpholine
SMILESC=CCC1CNCCO1
InChIInChI=1S/C7H13NO/c1-2-3-7-6-8-4-5-9-7/h2,7-8H,1,3-6H2
InChIKeyZMWLAPLKDFJITR-UHFFFAOYSA-N
MW127.19 g/mol
LogP0.55
Rot. Bonds2

About 2-prop-2-enylmorpholine

2-prop-2-enylmorpholine (PubChem CID 20536842) has the molecular formula C7H13NO and a molecular weight of 127.19 g/mol. Its IUPAC name is 2-prop-2-enylmorpholine.

Molecular Properties

Compound Name2-prop-2-enylmorpholine
PubChem CID20536842
Molecular FormulaC7H13NO
Molecular Weight127.19 g/mol
Exact Mass127.10
IUPAC Name2-prop-2-enylmorpholine
SMILESC=CCC1CNCCO1
InChIInChI=1S/C7H13NO/c1-2-3-7-6-8-4-5-9-7/h2,7-8H,1,3-6H2
InChIKeyZMWLAPLKDFJITR-UHFFFAOYSA-N
XLogP0.55
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500127.19
LogP ≤ 50.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

azane;2-prop-2-enylmorpholine
CID 66693360
2-(morpholin-2-ylmethyl)morpholine
CID 18506039
2-(3-methoxyprop-2-enyl)morpholine
CID 70497061
2-[[(2S)-oxiran-2-yl]methyl]morpholine
CID 87626819
[(2R)-morpholin-2-yl]methanol;hydrochloride
CID 42614735
2-morpholin-2-ylethanol;hydrofluoride
CID 69116594
(2S)-2-(methoxymethyl)morpholine;(2R)-2-(methoxymethyl)morpholine
CID 163652511
(2S)-2-(methoxymethyl)morpholine
CID 10103206
ethane;3-morpholin-2-ylpropanal
CID 142839724
1-morpholin-2-ylbutan-2-ol
CID 57136466
(2R)-2-[(E)-pent-3-enyl]morpholine
CID 130456713
2-(cyclopentylmethyl)morpholine
CID 55278350

Frequently Asked Questions

What is the IUPAC name of 2-prop-2-enylmorpholine?
The IUPAC name of 2-prop-2-enylmorpholine (CID 20536842) is 2-prop-2-enylmorpholine.
What is the SMILES notation for 2-prop-2-enylmorpholine?
The canonical SMILES for 2-prop-2-enylmorpholine is C=CCC1CNCCO1.
What is the InChIKey of 2-prop-2-enylmorpholine?
The InChIKey is ZMWLAPLKDFJITR-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13NO/c1-2-3-7-6-8-4-5-9-7/h2,7-8H,1,3-6H2.
What are the key properties of 2-prop-2-enylmorpholine?
2-prop-2-enylmorpholine has a molecular weight of 127.19 g/mol, XLogP of 0.55, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-prop-2-enylmorpholine is sourced from PubChem (CID 20536842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).