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

C14H26N2O3 — CID 86829274

IUPACN-[2-(2,2-dimethylmorpholin-4-yl)-2-oxoethyl]-3,3-dimethylbutanamide
SMILESCC(C)(C)CC(=O)NCC(=O)N1CCOC(C)(C)C1
InChIInChI=1S/C14H26N2O3/c1-13(2,3)8-11(17)15-9-12(18)16-6-7-19-14(4,5)10-16/h6-10H2,1-5H3,(H,15,17)
InChIKeyBPAFGOSGABWGIW-UHFFFAOYSA-N
MW270.37 g/mol
LogP1.18
Rot. Bonds3

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

N-[2-(2,2-dimethylmorpholin-4-yl)-2-oxoethyl]-3,3-dimethylbutanamide (PubChem CID 86829274) has the molecular formula C14H26N2O3 and a molecular weight of 270.37 g/mol. Its IUPAC name is N-[2-(2,2-dimethylmorpholin-4-yl)-2-oxoethyl]-3,3-dimethylbutanamide.

Molecular Properties

Compound NameN-[2-(2,2-dimethylmorpholin-4-yl)-2-oxoethyl]-3,3-dimethylbutanamide
PubChem CID86829274
Molecular FormulaC14H26N2O3
Molecular Weight270.37 g/mol
Exact Mass270.19
IUPAC NameN-[2-(2,2-dimethylmorpholin-4-yl)-2-oxoethyl]-3,3-dimethylbutanamide
SMILESCC(C)(C)CC(=O)NCC(=O)N1CCOC(C)(C)C1
InChIInChI=1S/C14H26N2O3/c1-13(2,3)8-11(17)15-9-12(18)16-6-7-19-14(4,5)10-16/h6-10H2,1-5H3,(H,15,17)
InChIKeyBPAFGOSGABWGIW-UHFFFAOYSA-N
XLogP1.18
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 ≤ 51.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[2-(2,2-dimethylmorpholin-4-yl)-2-oxoethyl]-3,3-dimethylbutanamide?
The IUPAC name of N-[2-(2,2-dimethylmorpholin-4-yl)-2-oxoethyl]-3,3-dimethylbutanamide (CID 86829274) is N-[2-(2,2-dimethylmorpholin-4-yl)-2-oxoethyl]-3,3-dimethylbutanamide.
What is the SMILES notation for N-[2-(2,2-dimethylmorpholin-4-yl)-2-oxoethyl]-3,3-dimethylbutanamide?
The canonical SMILES for N-[2-(2,2-dimethylmorpholin-4-yl)-2-oxoethyl]-3,3-dimethylbutanamide is CC(C)(C)CC(=O)NCC(=O)N1CCOC(C)(C)C1.
What is the InChIKey of N-[2-(2,2-dimethylmorpholin-4-yl)-2-oxoethyl]-3,3-dimethylbutanamide?
The InChIKey is BPAFGOSGABWGIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O3/c1-13(2,3)8-11(17)15-9-12(18)16-6-7-19-14(4,5)10-16/h6-10H2,1-5H3,(H,15,17).
What are the key properties of N-[2-(2,2-dimethylmorpholin-4-yl)-2-oxoethyl]-3,3-dimethylbutanamide?
N-[2-(2,2-dimethylmorpholin-4-yl)-2-oxoethyl]-3,3-dimethylbutanamide has a molecular weight of 270.37 g/mol, XLogP of 1.18, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2,2-dimethylmorpholin-4-yl)-2-oxoethyl]-3,3-dimethylbutanamide is sourced from PubChem (CID 86829274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).