2,2-dimethyl-4-prop-1-en-2-ylmorpholine

C9H17NO — CID 91327218

IUPAC2,2-dimethyl-4-prop-1-en-2-ylmorpholine
SMILESC=C(C)N1CCOC(C)(C)C1
InChIInChI=1S/C9H17NO/c1-8(2)10-5-6-11-9(3,4)7-10/h1,5-7H2,2-4H3
InChIKeyOPLYVANVYNYTII-UHFFFAOYSA-N
MW155.24 g/mol
LogP1.63
Rot. Bonds1

About 2,2-dimethyl-4-prop-1-en-2-ylmorpholine

2,2-dimethyl-4-prop-1-en-2-ylmorpholine (PubChem CID 91327218) has the molecular formula C9H17NO and a molecular weight of 155.24 g/mol. Its IUPAC name is 2,2-dimethyl-4-prop-1-en-2-ylmorpholine.

Molecular Properties

Compound Name2,2-dimethyl-4-prop-1-en-2-ylmorpholine
PubChem CID91327218
Molecular FormulaC9H17NO
Molecular Weight155.24 g/mol
Exact Mass155.13
IUPAC Name2,2-dimethyl-4-prop-1-en-2-ylmorpholine
SMILESC=C(C)N1CCOC(C)(C)C1
InChIInChI=1S/C9H17NO/c1-8(2)10-5-6-11-9(3,4)7-10/h1,5-7H2,2-4H3
InChIKeyOPLYVANVYNYTII-UHFFFAOYSA-N
XLogP1.63
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.24
LogP ≤ 51.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-4-prop-1-en-2-ylmorpholine?
The IUPAC name of 2,2-dimethyl-4-prop-1-en-2-ylmorpholine (CID 91327218) is 2,2-dimethyl-4-prop-1-en-2-ylmorpholine.
What is the SMILES notation for 2,2-dimethyl-4-prop-1-en-2-ylmorpholine?
The canonical SMILES for 2,2-dimethyl-4-prop-1-en-2-ylmorpholine is C=C(C)N1CCOC(C)(C)C1.
What is the InChIKey of 2,2-dimethyl-4-prop-1-en-2-ylmorpholine?
The InChIKey is OPLYVANVYNYTII-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NO/c1-8(2)10-5-6-11-9(3,4)7-10/h1,5-7H2,2-4H3.
What are the key properties of 2,2-dimethyl-4-prop-1-en-2-ylmorpholine?
2,2-dimethyl-4-prop-1-en-2-ylmorpholine has a molecular weight of 155.24 g/mol, XLogP of 1.63, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-4-prop-1-en-2-ylmorpholine is sourced from PubChem (CID 91327218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).