N-[2-(2,5-dimethylmorpholin-4-yl)-2-oxoethyl]-3,3-dimethylbutanamide

C14H26N2O3 — CID 47412713

IUPACN-[2-(2,5-dimethylmorpholin-4-yl)-2-oxoethyl]-3,3-dimethylbutanamide
SMILESCC1CN(C(=O)CNC(=O)CC(C)(C)C)C(C)CO1
InChIInChI=1S/C14H26N2O3/c1-10-9-19-11(2)8-16(10)13(18)7-15-12(17)6-14(3,4)5/h10-11H,6-9H2,1-5H3,(H,15,17)
InChIKeyAWJUMIXWARSRJE-UHFFFAOYSA-N
MW270.37 g/mol
LogP1.17
Rot. Bonds3

About N-[2-(2,5-dimethylmorpholin-4-yl)-2-oxoethyl]-3,3-dimethylbutanamide

N-[2-(2,5-dimethylmorpholin-4-yl)-2-oxoethyl]-3,3-dimethylbutanamide (PubChem CID 47412713) has the molecular formula C14H26N2O3 and a molecular weight of 270.37 g/mol. Its IUPAC name is N-[2-(2,5-dimethylmorpholin-4-yl)-2-oxoethyl]-3,3-dimethylbutanamide.

Molecular Properties

Compound NameN-[2-(2,5-dimethylmorpholin-4-yl)-2-oxoethyl]-3,3-dimethylbutanamide
PubChem CID47412713
Molecular FormulaC14H26N2O3
Molecular Weight270.37 g/mol
Exact Mass270.19
IUPAC NameN-[2-(2,5-dimethylmorpholin-4-yl)-2-oxoethyl]-3,3-dimethylbutanamide
SMILESCC1CN(C(=O)CNC(=O)CC(C)(C)C)C(C)CO1
InChIInChI=1S/C14H26N2O3/c1-10-9-19-11(2)8-16(10)13(18)7-15-12(17)6-14(3,4)5/h10-11H,6-9H2,1-5H3,(H,15,17)
InChIKeyAWJUMIXWARSRJE-UHFFFAOYSA-N
XLogP1.17
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.37
LogP ≤ 51.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[2-(2,5-dimethylmorpholin-4-yl)-2-oxoethyl]-3,3-dimethylbutanamide?
The IUPAC name of N-[2-(2,5-dimethylmorpholin-4-yl)-2-oxoethyl]-3,3-dimethylbutanamide (CID 47412713) is N-[2-(2,5-dimethylmorpholin-4-yl)-2-oxoethyl]-3,3-dimethylbutanamide.
What is the SMILES notation for N-[2-(2,5-dimethylmorpholin-4-yl)-2-oxoethyl]-3,3-dimethylbutanamide?
The canonical SMILES for N-[2-(2,5-dimethylmorpholin-4-yl)-2-oxoethyl]-3,3-dimethylbutanamide is CC1CN(C(=O)CNC(=O)CC(C)(C)C)C(C)CO1.
What is the InChIKey of N-[2-(2,5-dimethylmorpholin-4-yl)-2-oxoethyl]-3,3-dimethylbutanamide?
The InChIKey is AWJUMIXWARSRJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O3/c1-10-9-19-11(2)8-16(10)13(18)7-15-12(17)6-14(3,4)5/h10-11H,6-9H2,1-5H3,(H,15,17).
What are the key properties of N-[2-(2,5-dimethylmorpholin-4-yl)-2-oxoethyl]-3,3-dimethylbutanamide?
N-[2-(2,5-dimethylmorpholin-4-yl)-2-oxoethyl]-3,3-dimethylbutanamide has a molecular weight of 270.37 g/mol, XLogP of 1.17, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2,5-dimethylmorpholin-4-yl)-2-oxoethyl]-3,3-dimethylbutanamide is sourced from PubChem (CID 47412713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).