(2E,3E)-2,3-di(ethylidene)-4-methylmorpholine

C9H15NO — CID 131981942

IUPAC(2E,3E)-2,3-di(ethylidene)-4-methylmorpholine
SMILESC/C=C1/OCCN(C)/C1=C/C
InChIInChI=1S/C9H15NO/c1-4-8-9(5-2)11-7-6-10(8)3/h4-5H,6-7H2,1-3H3/b8-4+,9-5+
InChIKeyIMAWQXBSWYJRAX-KBXRYBNXSA-N
MW153.22 g/mol
LogP1.76
Rot. Bonds

About (2E,3E)-2,3-di(ethylidene)-4-methylmorpholine

(2E,3E)-2,3-di(ethylidene)-4-methylmorpholine (PubChem CID 131981942) has the molecular formula C9H15NO and a molecular weight of 153.22 g/mol. Its IUPAC name is (2E,3E)-2,3-di(ethylidene)-4-methylmorpholine.

Molecular Properties

Compound Name(2E,3E)-2,3-di(ethylidene)-4-methylmorpholine
PubChem CID131981942
Molecular FormulaC9H15NO
Molecular Weight153.22 g/mol
Exact Mass153.12
IUPAC Name(2E,3E)-2,3-di(ethylidene)-4-methylmorpholine
SMILESC/C=C1/OCCN(C)/C1=C/C
InChIInChI=1S/C9H15NO/c1-4-8-9(5-2)11-7-6-10(8)3/h4-5H,6-7H2,1-3H3/b8-4+,9-5+
InChIKeyIMAWQXBSWYJRAX-KBXRYBNXSA-N
XLogP1.76
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.22
LogP ≤ 51.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2E,3E)-2,3-di(ethylidene)-4-methylmorpholine?
The IUPAC name of (2E,3E)-2,3-di(ethylidene)-4-methylmorpholine (CID 131981942) is (2E,3E)-2,3-di(ethylidene)-4-methylmorpholine.
What is the SMILES notation for (2E,3E)-2,3-di(ethylidene)-4-methylmorpholine?
The canonical SMILES for (2E,3E)-2,3-di(ethylidene)-4-methylmorpholine is C/C=C1/OCCN(C)/C1=C/C.
What is the InChIKey of (2E,3E)-2,3-di(ethylidene)-4-methylmorpholine?
The InChIKey is IMAWQXBSWYJRAX-KBXRYBNXSA-N. The full InChI is InChI=1S/C9H15NO/c1-4-8-9(5-2)11-7-6-10(8)3/h4-5H,6-7H2,1-3H3/b8-4+,9-5+.
What are the key properties of (2E,3E)-2,3-di(ethylidene)-4-methylmorpholine?
(2E,3E)-2,3-di(ethylidene)-4-methylmorpholine has a molecular weight of 153.22 g/mol, XLogP of 1.76, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2E,3E)-2,3-di(ethylidene)-4-methylmorpholine is sourced from PubChem (CID 131981942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).