2-amino-2-methyl-1-(2-methylmorpholin-4-yl)pentan-1-one

C11H22N2O2 — CID 60848917

IUPAC2-amino-2-methyl-1-(2-methylmorpholin-4-yl)pentan-1-one
SMILESCCCC(C)(N)C(=O)N1CCOC(C)C1
InChIInChI=1S/C11H22N2O2/c1-4-5-11(3,12)10(14)13-6-7-15-9(2)8-13/h9H,4-8,12H2,1-3H3
InChIKeyXUAJWYOPPURWGX-UHFFFAOYSA-N
MW214.31 g/mol
LogP0.75
Rot. Bonds3

About 2-amino-2-methyl-1-(2-methylmorpholin-4-yl)pentan-1-one

2-amino-2-methyl-1-(2-methylmorpholin-4-yl)pentan-1-one (PubChem CID 60848917) has the molecular formula C11H22N2O2 and a molecular weight of 214.31 g/mol. Its IUPAC name is 2-amino-2-methyl-1-(2-methylmorpholin-4-yl)pentan-1-one.

Molecular Properties

Compound Name2-amino-2-methyl-1-(2-methylmorpholin-4-yl)pentan-1-one
PubChem CID60848917
Molecular FormulaC11H22N2O2
Molecular Weight214.31 g/mol
Exact Mass214.17
IUPAC Name2-amino-2-methyl-1-(2-methylmorpholin-4-yl)pentan-1-one
SMILESCCCC(C)(N)C(=O)N1CCOC(C)C1
InChIInChI=1S/C11H22N2O2/c1-4-5-11(3,12)10(14)13-6-7-15-9(2)8-13/h9H,4-8,12H2,1-3H3
InChIKeyXUAJWYOPPURWGX-UHFFFAOYSA-N
XLogP0.75
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 50.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-amino-2-methyl-1-(2-methylmorpholin-4-yl)pentan-1-one?
The IUPAC name of 2-amino-2-methyl-1-(2-methylmorpholin-4-yl)pentan-1-one (CID 60848917) is 2-amino-2-methyl-1-(2-methylmorpholin-4-yl)pentan-1-one.
What is the SMILES notation for 2-amino-2-methyl-1-(2-methylmorpholin-4-yl)pentan-1-one?
The canonical SMILES for 2-amino-2-methyl-1-(2-methylmorpholin-4-yl)pentan-1-one is CCCC(C)(N)C(=O)N1CCOC(C)C1.
What is the InChIKey of 2-amino-2-methyl-1-(2-methylmorpholin-4-yl)pentan-1-one?
The InChIKey is XUAJWYOPPURWGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O2/c1-4-5-11(3,12)10(14)13-6-7-15-9(2)8-13/h9H,4-8,12H2,1-3H3.
What are the key properties of 2-amino-2-methyl-1-(2-methylmorpholin-4-yl)pentan-1-one?
2-amino-2-methyl-1-(2-methylmorpholin-4-yl)pentan-1-one has a molecular weight of 214.31 g/mol, XLogP of 0.75, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-methyl-1-(2-methylmorpholin-4-yl)pentan-1-one is sourced from PubChem (CID 60848917), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).