N-(1-methoxyethyl)-2,2-dimethylpropanamide

C8H17NO2 — CID 71723059

IUPACN-(1-methoxyethyl)-2,2-dimethylpropanamide
SMILESCOC(C)NC(=O)C(C)(C)C
InChIInChI=1S/C8H17NO2/c1-6(11-5)9-7(10)8(2,3)4/h6H,1-5H3,(H,9,10)
InChIKeyRJAFVAZPZYIHDG-UHFFFAOYSA-N
MW159.23 g/mol
LogP1.14
Rot. Bonds2

About N-(1-methoxyethyl)-2,2-dimethylpropanamide

N-(1-methoxyethyl)-2,2-dimethylpropanamide (PubChem CID 71723059) has the molecular formula C8H17NO2 and a molecular weight of 159.23 g/mol. Its IUPAC name is N-(1-methoxyethyl)-2,2-dimethylpropanamide.

Molecular Properties

Compound NameN-(1-methoxyethyl)-2,2-dimethylpropanamide
PubChem CID71723059
Molecular FormulaC8H17NO2
Molecular Weight159.23 g/mol
Exact Mass159.13
IUPAC NameN-(1-methoxyethyl)-2,2-dimethylpropanamide
SMILESCOC(C)NC(=O)C(C)(C)C
InChIInChI=1S/C8H17NO2/c1-6(11-5)9-7(10)8(2,3)4/h6H,1-5H3,(H,9,10)
InChIKeyRJAFVAZPZYIHDG-UHFFFAOYSA-N
XLogP1.14
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.23
LogP ≤ 51.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

Propanamide, N-isobutyl-2,2-dimethyl
CID 528633
Propanamide, N-butyl-2,2-dimethyl
CID 528628
2-fluoro-N-(3-methoxy-2,2-dimethylpropyl)acetamide
CID 88936094
N-(3-ethoxy-2-fluoropropyl)-2-methylpropanamide
CID 167191755
Propanamide, N,N'-1,3-propanediylbis[2,2-dimethyl-
CID 2164928
N-[4-(2,2-dimethylpropanoylamino)butyl]-2,2-dimethylpropanamide
CID 5142904
N-(2,2-Dimethyl-propyl)-propionamide
CID 533906
2,2-dimethyl-N-(4-oxobutyl)propanamide
CID 15883442
N-(1-ethoxy-2-methylpropyl)propanamide
CID 134949251
N-(3-iodo-1-methoxypropyl)-2,2-dimethylpropanamide
CID 176423367
2-fluoro-2-methyl-N-[(3-methyloxetan-3-yl)methyl]propanamide
CID 126972955
N-(2-fluoro-3-methoxypropyl)-2-methylpropanamide
CID 168259013

Frequently Asked Questions

What is the IUPAC name of N-(1-methoxyethyl)-2,2-dimethylpropanamide?
The IUPAC name of N-(1-methoxyethyl)-2,2-dimethylpropanamide (CID 71723059) is N-(1-methoxyethyl)-2,2-dimethylpropanamide.
What is the SMILES notation for N-(1-methoxyethyl)-2,2-dimethylpropanamide?
The canonical SMILES for N-(1-methoxyethyl)-2,2-dimethylpropanamide is COC(C)NC(=O)C(C)(C)C.
What is the InChIKey of N-(1-methoxyethyl)-2,2-dimethylpropanamide?
The InChIKey is RJAFVAZPZYIHDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO2/c1-6(11-5)9-7(10)8(2,3)4/h6H,1-5H3,(H,9,10).
What are the key properties of N-(1-methoxyethyl)-2,2-dimethylpropanamide?
N-(1-methoxyethyl)-2,2-dimethylpropanamide has a molecular weight of 159.23 g/mol, XLogP of 1.14, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methoxyethyl)-2,2-dimethylpropanamide is sourced from PubChem (CID 71723059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).