ethane;2-ethenylidene-4-ethyl-3-methylidenemorpholine

C13H25NO — CID 90968281

IUPACethane;2-ethenylidene-4-ethyl-3-methylidenemorpholine
SMILESC=C=C1OCCN(CC)C1=C.CC.CC
InChIInChI=1S/C9H13NO.2C2H6/c1-4-9-8(3)10(5-2)6-7-11-9;2*1-2/h1,3,5-7H2,2H3;2*1-2H3
InChIKeyNRXXLHLLBYBSHA-UHFFFAOYSA-N
MW211.35 g/mol
LogP3.57
Rot. Bonds1

About ethane;2-ethenylidene-4-ethyl-3-methylidenemorpholine

ethane;2-ethenylidene-4-ethyl-3-methylidenemorpholine (PubChem CID 90968281) has the molecular formula C13H25NO and a molecular weight of 211.35 g/mol. Its IUPAC name is ethane;2-ethenylidene-4-ethyl-3-methylidenemorpholine.

Molecular Properties

Compound Nameethane;2-ethenylidene-4-ethyl-3-methylidenemorpholine
PubChem CID90968281
Molecular FormulaC13H25NO
Molecular Weight211.35 g/mol
Exact Mass211.19
IUPAC Nameethane;2-ethenylidene-4-ethyl-3-methylidenemorpholine
SMILESC=C=C1OCCN(CC)C1=C.CC.CC
InChIInChI=1S/C9H13NO.2C2H6/c1-4-9-8(3)10(5-2)6-7-11-9;2*1-2/h1,3,5-7H2,2H3;2*1-2H3
InChIKeyNRXXLHLLBYBSHA-UHFFFAOYSA-N
XLogP3.57
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.35
LogP ≤ 53.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

Morpholine, 4-(2-ethoxy-1-methylene-2-propenyl)-
CID 10797546
(2Z)-4-ethyl-2-(1-fluoroethylidene)-5-methyl-3-methylidenemorpholine
CID 142486810
4-Methyl-3-methylidenemorpholine
CID 57757749
2-Ethenylidene-4-ethyl-3-methylidenemorpholine
CID 59306100
4-Ethyl-3-methylidenemorpholine
CID 59347263
3-Methylidene-4-propan-2-ylmorpholine
CID 59374027
4-(3-Propan-2-yloxyprop-1-en-2-yl)morpholine
CID 68267222
4-(3-Methoxyprop-1-en-2-yl)morpholine
CID 89017332
4-Methyl-2,3-dimethylidenemorpholine
CID 89046999
4,4-Dimethyl-3-methylidene-2-propan-2-ylidenemorpholin-4-ium
CID 89047024
4-Tert-butyl-3-methylidenemorpholine
CID 89103067
4,4-Dimethyl-2,3-dimethylidenemorpholin-4-ium
CID 89374272

Frequently Asked Questions

What is the IUPAC name of ethane;2-ethenylidene-4-ethyl-3-methylidenemorpholine?
The IUPAC name of ethane;2-ethenylidene-4-ethyl-3-methylidenemorpholine (CID 90968281) is ethane;2-ethenylidene-4-ethyl-3-methylidenemorpholine.
What is the SMILES notation for ethane;2-ethenylidene-4-ethyl-3-methylidenemorpholine?
The canonical SMILES for ethane;2-ethenylidene-4-ethyl-3-methylidenemorpholine is C=C=C1OCCN(CC)C1=C.CC.CC.
What is the InChIKey of ethane;2-ethenylidene-4-ethyl-3-methylidenemorpholine?
The InChIKey is NRXXLHLLBYBSHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13NO.2C2H6/c1-4-9-8(3)10(5-2)6-7-11-9;2*1-2/h1,3,5-7H2,2H3;2*1-2H3.
What are the key properties of ethane;2-ethenylidene-4-ethyl-3-methylidenemorpholine?
ethane;2-ethenylidene-4-ethyl-3-methylidenemorpholine has a molecular weight of 211.35 g/mol, XLogP of 3.57, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;2-ethenylidene-4-ethyl-3-methylidenemorpholine is sourced from PubChem (CID 90968281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).