N-ethyl-N-[1-(1-methoxy-2-methylpropan-2-yl)oxy-2-methylpropan-2-yl]-2-methylbutanamide

C16H33NO3 — CID 177240091

IUPACN-ethyl-N-[1-(1-methoxy-2-methylpropan-2-yl)oxy-2-methylpropan-2-yl]-2-methylbutanamide
SMILESCCC(C)C(=O)N(CC)C(C)(C)COC(C)(C)COC
InChIInChI=1S/C16H33NO3/c1-9-13(3)14(18)17(10-2)15(4,5)11-20-16(6,7)12-19-8/h13H,9-12H2,1-8H3
InChIKeyFFDXDFSGXFUUMP-UHFFFAOYSA-N
MW287.44 g/mol
LogP3.10
Rot. Bonds9

About N-ethyl-N-[1-(1-methoxy-2-methylpropan-2-yl)oxy-2-methylpropan-2-yl]-2-methylbutanamide

N-ethyl-N-[1-(1-methoxy-2-methylpropan-2-yl)oxy-2-methylpropan-2-yl]-2-methylbutanamide (PubChem CID 177240091) has the molecular formula C16H33NO3 and a molecular weight of 287.44 g/mol. Its IUPAC name is N-ethyl-N-[1-(1-methoxy-2-methylpropan-2-yl)oxy-2-methylpropan-2-yl]-2-methylbutanamide.

Molecular Properties

Compound NameN-ethyl-N-[1-(1-methoxy-2-methylpropan-2-yl)oxy-2-methylpropan-2-yl]-2-methylbutanamide
PubChem CID177240091
Molecular FormulaC16H33NO3
Molecular Weight287.44 g/mol
Exact Mass287.25
IUPAC NameN-ethyl-N-[1-(1-methoxy-2-methylpropan-2-yl)oxy-2-methylpropan-2-yl]-2-methylbutanamide
SMILESCCC(C)C(=O)N(CC)C(C)(C)COC(C)(C)COC
InChIInChI=1S/C16H33NO3/c1-9-13(3)14(18)17(10-2)15(4,5)11-20-16(6,7)12-19-8/h13H,9-12H2,1-8H3
InChIKeyFFDXDFSGXFUUMP-UHFFFAOYSA-N
XLogP3.10
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.44
LogP ≤ 53.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-3-hydroxy-2-methyl-N-(2-methylbutan-2-yl)propanamide
CID 146416839
(2S)-N,N-diethyl-2-methylbutanamide
CID 158106259
N-acetyl-N,2-dimethylbutanamide;ethane
CID 177191863
N-ethyl-N,2-dimethylbutanamide
CID 89343843
N-(2-methoxyethyl)-2-methyl-N-(2-methylpropyl)butanamide
CID 78854118
3-methyl-1-(2-methyl-1-propan-2-yloxypropan-2-yl)oxypentan-2-one
CID 167150248
N-tert-butyl-N-(2-cyanoethyl)-2-methylbutanamide
CID 58434930
N-(4-aminobutyl)-N-tert-butyl-2-methylbutanamide
CID 89022443
(2R)-N-hydroxy-N,2-dimethylbutanamide
CID 171076136
[ethyl(2-methylbutanoyl)amino]phosphonic acid
CID 87900288
methyl 2-methylbutanoate;1,1,1-trifluoroethane
CID 91439197
2-methylbutanoyloxymethyl 2-methylbutanoate
CID 20789926

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-[1-(1-methoxy-2-methylpropan-2-yl)oxy-2-methylpropan-2-yl]-2-methylbutanamide?
The IUPAC name of N-ethyl-N-[1-(1-methoxy-2-methylpropan-2-yl)oxy-2-methylpropan-2-yl]-2-methylbutanamide (CID 177240091) is N-ethyl-N-[1-(1-methoxy-2-methylpropan-2-yl)oxy-2-methylpropan-2-yl]-2-methylbutanamide.
What is the SMILES notation for N-ethyl-N-[1-(1-methoxy-2-methylpropan-2-yl)oxy-2-methylpropan-2-yl]-2-methylbutanamide?
The canonical SMILES for N-ethyl-N-[1-(1-methoxy-2-methylpropan-2-yl)oxy-2-methylpropan-2-yl]-2-methylbutanamide is CCC(C)C(=O)N(CC)C(C)(C)COC(C)(C)COC.
What is the InChIKey of N-ethyl-N-[1-(1-methoxy-2-methylpropan-2-yl)oxy-2-methylpropan-2-yl]-2-methylbutanamide?
The InChIKey is FFDXDFSGXFUUMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H33NO3/c1-9-13(3)14(18)17(10-2)15(4,5)11-20-16(6,7)12-19-8/h13H,9-12H2,1-8H3.
What are the key properties of N-ethyl-N-[1-(1-methoxy-2-methylpropan-2-yl)oxy-2-methylpropan-2-yl]-2-methylbutanamide?
N-ethyl-N-[1-(1-methoxy-2-methylpropan-2-yl)oxy-2-methylpropan-2-yl]-2-methylbutanamide has a molecular weight of 287.44 g/mol, XLogP of 3.10, 9 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-[1-(1-methoxy-2-methylpropan-2-yl)oxy-2-methylpropan-2-yl]-2-methylbutanamide is sourced from PubChem (CID 177240091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).