2-(2,2-dimethylpropyl)-4-methylmorpholine

C10H21NO — CID 58530603

IUPAC2-(2,2-dimethylpropyl)-4-methylmorpholine
SMILESCN1CCOC(CC(C)(C)C)C1
InChIInChI=1S/C10H21NO/c1-10(2,3)7-9-8-11(4)5-6-12-9/h9H,5-8H2,1-4H3
InChIKeyOPLVXCORPBGDSW-UHFFFAOYSA-N
MW171.28 g/mol
LogP1.75
Rot. Bonds1

About 2-(2,2-dimethylpropyl)-4-methylmorpholine

2-(2,2-dimethylpropyl)-4-methylmorpholine (PubChem CID 58530603) has the molecular formula C10H21NO and a molecular weight of 171.28 g/mol. Its IUPAC name is 2-(2,2-dimethylpropyl)-4-methylmorpholine.

Molecular Properties

Compound Name2-(2,2-dimethylpropyl)-4-methylmorpholine
PubChem CID58530603
Molecular FormulaC10H21NO
Molecular Weight171.28 g/mol
Exact Mass171.16
IUPAC Name2-(2,2-dimethylpropyl)-4-methylmorpholine
SMILESCN1CCOC(CC(C)(C)C)C1
InChIInChI=1S/C10H21NO/c1-10(2,3)7-9-8-11(4)5-6-12-9/h9H,5-8H2,1-4H3
InChIKeyOPLVXCORPBGDSW-UHFFFAOYSA-N
XLogP1.75
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.28
LogP ≤ 51.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2,2-dimethylpropyl)-4-methylmorpholine?
The IUPAC name of 2-(2,2-dimethylpropyl)-4-methylmorpholine (CID 58530603) is 2-(2,2-dimethylpropyl)-4-methylmorpholine.
What is the SMILES notation for 2-(2,2-dimethylpropyl)-4-methylmorpholine?
The canonical SMILES for 2-(2,2-dimethylpropyl)-4-methylmorpholine is CN1CCOC(CC(C)(C)C)C1.
What is the InChIKey of 2-(2,2-dimethylpropyl)-4-methylmorpholine?
The InChIKey is OPLVXCORPBGDSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO/c1-10(2,3)7-9-8-11(4)5-6-12-9/h9H,5-8H2,1-4H3.
What are the key properties of 2-(2,2-dimethylpropyl)-4-methylmorpholine?
2-(2,2-dimethylpropyl)-4-methylmorpholine has a molecular weight of 171.28 g/mol, XLogP of 1.75, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,2-dimethylpropyl)-4-methylmorpholine is sourced from PubChem (CID 58530603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).