2-methylidenemorpholine

C5H9NO — CID 21333560

IUPAC2-methylidenemorpholine
SMILESC=C1CNCCO1
InChIInChI=1S/C5H9NO/c1-5-4-6-2-3-7-5/h6H,1-4H2
InChIKeyCQKJQBXBQRLAMS-UHFFFAOYSA-N
MW99.13 g/mol
LogP0.12
Rot. Bonds

About 2-methylidenemorpholine

2-methylidenemorpholine (PubChem CID 21333560) has the molecular formula C5H9NO and a molecular weight of 99.13 g/mol. Its IUPAC name is 2-methylidenemorpholine.

Molecular Properties

Compound Name2-methylidenemorpholine
PubChem CID21333560
Molecular FormulaC5H9NO
Molecular Weight99.13 g/mol
Exact Mass99.07
IUPAC Name2-methylidenemorpholine
SMILESC=C1CNCCO1
InChIInChI=1S/C5H9NO/c1-5-4-6-2-3-7-5/h6H,1-4H2
InChIKeyCQKJQBXBQRLAMS-UHFFFAOYSA-N
XLogP0.12
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50099.13
LogP ≤ 50.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methylidenemorpholine?
The IUPAC name of 2-methylidenemorpholine (CID 21333560) is 2-methylidenemorpholine.
What is the SMILES notation for 2-methylidenemorpholine?
The canonical SMILES for 2-methylidenemorpholine is C=C1CNCCO1.
What is the InChIKey of 2-methylidenemorpholine?
The InChIKey is CQKJQBXBQRLAMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9NO/c1-5-4-6-2-3-7-5/h6H,1-4H2.
What are the key properties of 2-methylidenemorpholine?
2-methylidenemorpholine has a molecular weight of 99.13 g/mol, XLogP of 0.12, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylidenemorpholine is sourced from PubChem (CID 21333560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).