2,2-bis(prop-2-enyl)morpholine

C10H17NO — CID 21271343

IUPAC2,2-bis(prop-2-enyl)morpholine
SMILESC=CCC1(CC=C)CNCCO1
InChIInChI=1S/C10H17NO/c1-3-5-10(6-4-2)9-11-7-8-12-10/h3-4,11H,1-2,5-9H2
InChIKeyDQEDFRQHJATMIU-UHFFFAOYSA-N
MW167.25 g/mol
LogP1.50
Rot. Bonds4

About 2,2-bis(prop-2-enyl)morpholine

2,2-bis(prop-2-enyl)morpholine (PubChem CID 21271343) has the molecular formula C10H17NO and a molecular weight of 167.25 g/mol. Its IUPAC name is 2,2-bis(prop-2-enyl)morpholine.

Molecular Properties

Compound Name2,2-bis(prop-2-enyl)morpholine
PubChem CID21271343
Molecular FormulaC10H17NO
Molecular Weight167.25 g/mol
Exact Mass167.13
IUPAC Name2,2-bis(prop-2-enyl)morpholine
SMILESC=CCC1(CC=C)CNCCO1
InChIInChI=1S/C10H17NO/c1-3-5-10(6-4-2)9-11-7-8-12-10/h3-4,11H,1-2,5-9H2
InChIKeyDQEDFRQHJATMIU-UHFFFAOYSA-N
XLogP1.50
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.25
LogP ≤ 51.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2,2-bis(prop-2-enyl)morpholine?
The IUPAC name of 2,2-bis(prop-2-enyl)morpholine (CID 21271343) is 2,2-bis(prop-2-enyl)morpholine.
What is the SMILES notation for 2,2-bis(prop-2-enyl)morpholine?
The canonical SMILES for 2,2-bis(prop-2-enyl)morpholine is C=CCC1(CC=C)CNCCO1.
What is the InChIKey of 2,2-bis(prop-2-enyl)morpholine?
The InChIKey is DQEDFRQHJATMIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO/c1-3-5-10(6-4-2)9-11-7-8-12-10/h3-4,11H,1-2,5-9H2.
What are the key properties of 2,2-bis(prop-2-enyl)morpholine?
2,2-bis(prop-2-enyl)morpholine has a molecular weight of 167.25 g/mol, XLogP of 1.50, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-bis(prop-2-enyl)morpholine is sourced from PubChem (CID 21271343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).