N-(2-methoxyethyl)-N-methyl-4-propan-2-yloxybutanamide

C11H23NO3 — CID 167520317

IUPACN-(2-methoxyethyl)-N-methyl-4-propan-2-yloxybutanamide
SMILESCOCCN(C)C(=O)CCCOC(C)C
InChIInChI=1S/C11H23NO3/c1-10(2)15-8-5-6-11(13)12(3)7-9-14-4/h10H,5-9H2,1-4H3
InChIKeyCEGSCLAQIHHJFZ-UHFFFAOYSA-N
MW217.31 g/mol
LogP1.30
Rot. Bonds8

About N-(2-methoxyethyl)-N-methyl-4-propan-2-yloxybutanamide

N-(2-methoxyethyl)-N-methyl-4-propan-2-yloxybutanamide (PubChem CID 167520317) has the molecular formula C11H23NO3 and a molecular weight of 217.31 g/mol. Its IUPAC name is N-(2-methoxyethyl)-N-methyl-4-propan-2-yloxybutanamide.

Molecular Properties

Compound NameN-(2-methoxyethyl)-N-methyl-4-propan-2-yloxybutanamide
PubChem CID167520317
Molecular FormulaC11H23NO3
Molecular Weight217.31 g/mol
Exact Mass217.17
IUPAC NameN-(2-methoxyethyl)-N-methyl-4-propan-2-yloxybutanamide
SMILESCOCCN(C)C(=O)CCCOC(C)C
InChIInChI=1S/C11H23NO3/c1-10(2)15-8-5-6-11(13)12(3)7-9-14-4/h10H,5-9H2,1-4H3
InChIKeyCEGSCLAQIHHJFZ-UHFFFAOYSA-N
XLogP1.30
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.31
LogP ≤ 51.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

1-(2,6-Dimethylmorpholin-4-yl)butan-1-one
CID 304072
2-[Butanoyl(methyl)amino]ethyl butanoate
CID 91712859
N,N-diethyloxetane-2-carboxamide
CID 12424334
1-[(2S,6R)-2,6-dimethylmorpholin-4-yl]butan-1-one
CID 27844261
2-butoxy-N,N-diethylpropanamide
CID 48650859
2-butoxy-N,N-dipropylpropanamide
CID 48656360
N-(2-methoxybutyl)-N-(methoxymethyl)acetamide
CID 53875712
1-[2-(2-Methoxyethyl)morpholin-4-yl]ethanone
CID 57563463
N-methyl-N-(2-propan-2-yloxyethyl)cyclopropanecarboxamide
CID 57643826
N,N-dimethyl-4-propan-2-yloxybutanamide
CID 58139943
4-Propan-2-yloxy-1-pyrrolidin-1-ylbutan-1-one
CID 58140120
N-cyclopropyl-4-propan-2-yloxy-N-propylbutanamide
CID 58375896

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-N-methyl-4-propan-2-yloxybutanamide?
The IUPAC name of N-(2-methoxyethyl)-N-methyl-4-propan-2-yloxybutanamide (CID 167520317) is N-(2-methoxyethyl)-N-methyl-4-propan-2-yloxybutanamide.
What is the SMILES notation for N-(2-methoxyethyl)-N-methyl-4-propan-2-yloxybutanamide?
The canonical SMILES for N-(2-methoxyethyl)-N-methyl-4-propan-2-yloxybutanamide is COCCN(C)C(=O)CCCOC(C)C.
What is the InChIKey of N-(2-methoxyethyl)-N-methyl-4-propan-2-yloxybutanamide?
The InChIKey is CEGSCLAQIHHJFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO3/c1-10(2)15-8-5-6-11(13)12(3)7-9-14-4/h10H,5-9H2,1-4H3.
What are the key properties of N-(2-methoxyethyl)-N-methyl-4-propan-2-yloxybutanamide?
N-(2-methoxyethyl)-N-methyl-4-propan-2-yloxybutanamide has a molecular weight of 217.31 g/mol, XLogP of 1.30, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-N-methyl-4-propan-2-yloxybutanamide is sourced from PubChem (CID 167520317), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).