(2E,3E)-2,3-bis(prop-2-enylidene)morpholine;ethane;N-methylacetamide

C15H26N2O2 — CID 144958626

IUPAC(2E,3E)-2,3-bis(prop-2-enylidene)morpholine;ethane;N-methylacetamide
SMILESC=C/C=C1/NCCO/C1=C/C=C.CC.CNC(C)=O
InChIInChI=1S/C10H13NO.C3H7NO.C2H6/c1-3-5-9-10(6-4-2)12-8-7-11-9;1-3(5)4-2;1-2/h3-6,11H,1-2,7-8H2;1-2H3,(H,4,5);1-2H3/b9-5+,10-6+;;
InChIKeyXJHPGTQCSAWVCU-ODPWVAJHSA-N
MW266.38 g/mol
LogP2.52
Rot. Bonds2

About (2E,3E)-2,3-bis(prop-2-enylidene)morpholine;ethane;N-methylacetamide

(2E,3E)-2,3-bis(prop-2-enylidene)morpholine;ethane;N-methylacetamide (PubChem CID 144958626) has the molecular formula C15H26N2O2 and a molecular weight of 266.38 g/mol. Its IUPAC name is (2E,3E)-2,3-bis(prop-2-enylidene)morpholine;ethane;N-methylacetamide.

Molecular Properties

Compound Name(2E,3E)-2,3-bis(prop-2-enylidene)morpholine;ethane;N-methylacetamide
PubChem CID144958626
Molecular FormulaC15H26N2O2
Molecular Weight266.38 g/mol
Exact Mass266.20
IUPAC Name(2E,3E)-2,3-bis(prop-2-enylidene)morpholine;ethane;N-methylacetamide
SMILESC=C/C=C1/NCCO/C1=C/C=C.CC.CNC(C)=O
InChIInChI=1S/C10H13NO.C3H7NO.C2H6/c1-3-5-9-10(6-4-2)12-8-7-11-9;1-3(5)4-2;1-2/h3-6,11H,1-2,7-8H2;1-2H3,(H,4,5);1-2H3/b9-5+,10-6+;;
InChIKeyXJHPGTQCSAWVCU-ODPWVAJHSA-N
XLogP2.52
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.38
LogP ≤ 52.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2E,3E)-2,3-bis(prop-2-enylidene)morpholine;ethane;N-methylacetamide?
The IUPAC name of (2E,3E)-2,3-bis(prop-2-enylidene)morpholine;ethane;N-methylacetamide (CID 144958626) is (2E,3E)-2,3-bis(prop-2-enylidene)morpholine;ethane;N-methylacetamide.
What is the SMILES notation for (2E,3E)-2,3-bis(prop-2-enylidene)morpholine;ethane;N-methylacetamide?
The canonical SMILES for (2E,3E)-2,3-bis(prop-2-enylidene)morpholine;ethane;N-methylacetamide is C=C/C=C1/NCCO/C1=C/C=C.CC.CNC(C)=O.
What is the InChIKey of (2E,3E)-2,3-bis(prop-2-enylidene)morpholine;ethane;N-methylacetamide?
The InChIKey is XJHPGTQCSAWVCU-ODPWVAJHSA-N. The full InChI is InChI=1S/C10H13NO.C3H7NO.C2H6/c1-3-5-9-10(6-4-2)12-8-7-11-9;1-3(5)4-2;1-2/h3-6,11H,1-2,7-8H2;1-2H3,(H,4,5);1-2H3/b9-5+,10-6+;;.
What are the key properties of (2E,3E)-2,3-bis(prop-2-enylidene)morpholine;ethane;N-methylacetamide?
(2E,3E)-2,3-bis(prop-2-enylidene)morpholine;ethane;N-methylacetamide has a molecular weight of 266.38 g/mol, XLogP of 2.52, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2E,3E)-2,3-bis(prop-2-enylidene)morpholine;ethane;N-methylacetamide is sourced from PubChem (CID 144958626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).