ethane;4-methyl-3-methylidenemorpholine

C8H17NO — CID 91585735

IUPACethane;4-methyl-3-methylidenemorpholine
SMILESC=C1COCCN1C.CC
InChIInChI=1S/C6H11NO.C2H6/c1-6-5-8-4-3-7(6)2;1-2/h1,3-5H2,2H3;1-2H3
InChIKeyXHZOFVIYXWDAIT-UHFFFAOYSA-N
MW143.23 g/mol
LogP1.49
Rot. Bonds

About ethane;4-methyl-3-methylidenemorpholine

ethane;4-methyl-3-methylidenemorpholine (PubChem CID 91585735) has the molecular formula C8H17NO and a molecular weight of 143.23 g/mol. Its IUPAC name is ethane;4-methyl-3-methylidenemorpholine.

Molecular Properties

Compound Nameethane;4-methyl-3-methylidenemorpholine
PubChem CID91585735
Molecular FormulaC8H17NO
Molecular Weight143.23 g/mol
Exact Mass143.13
IUPAC Nameethane;4-methyl-3-methylidenemorpholine
SMILESC=C1COCCN1C.CC
InChIInChI=1S/C6H11NO.C2H6/c1-6-5-8-4-3-7(6)2;1-2/h1,3-5H2,2H3;1-2H3
InChIKeyXHZOFVIYXWDAIT-UHFFFAOYSA-N
XLogP1.49
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.23
LogP ≤ 51.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of ethane;4-methyl-3-methylidenemorpholine?
The IUPAC name of ethane;4-methyl-3-methylidenemorpholine (CID 91585735) is ethane;4-methyl-3-methylidenemorpholine.
What is the SMILES notation for ethane;4-methyl-3-methylidenemorpholine?
The canonical SMILES for ethane;4-methyl-3-methylidenemorpholine is C=C1COCCN1C.CC.
What is the InChIKey of ethane;4-methyl-3-methylidenemorpholine?
The InChIKey is XHZOFVIYXWDAIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11NO.C2H6/c1-6-5-8-4-3-7(6)2;1-2/h1,3-5H2,2H3;1-2H3.
What are the key properties of ethane;4-methyl-3-methylidenemorpholine?
ethane;4-methyl-3-methylidenemorpholine has a molecular weight of 143.23 g/mol, XLogP of 1.49, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;4-methyl-3-methylidenemorpholine is sourced from PubChem (CID 91585735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).