N-(2-methoxyethyl)-N,2-dimethylprop-2-enamide

C8H15NO2 — CID 22677235

IUPACN-(2-methoxyethyl)-N,2-dimethylprop-2-enamide
SMILESC=C(C)C(=O)N(C)CCOC
InChIInChI=1S/C8H15NO2/c1-7(2)8(10)9(3)5-6-11-4/h1,5-6H2,2-4H3
InChIKeyLPOBKPYYGMYJAO-UHFFFAOYSA-N
MW157.21 g/mol
LogP0.67
Rot. Bonds4

About N-(2-methoxyethyl)-N,2-dimethylprop-2-enamide

N-(2-methoxyethyl)-N,2-dimethylprop-2-enamide (PubChem CID 22677235) has the molecular formula C8H15NO2 and a molecular weight of 157.21 g/mol. Its IUPAC name is N-(2-methoxyethyl)-N,2-dimethylprop-2-enamide.

Molecular Properties

Compound NameN-(2-methoxyethyl)-N,2-dimethylprop-2-enamide
PubChem CID22677235
Molecular FormulaC8H15NO2
Molecular Weight157.21 g/mol
Exact Mass157.11
IUPAC NameN-(2-methoxyethyl)-N,2-dimethylprop-2-enamide
SMILESC=C(C)C(=O)N(C)CCOC
InChIInChI=1S/C8H15NO2/c1-7(2)8(10)9(3)5-6-11-4/h1,5-6H2,2-4H3
InChIKeyLPOBKPYYGMYJAO-UHFFFAOYSA-N
XLogP0.67
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.21
LogP ≤ 50.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-N,2-dimethylprop-2-enamide?
The IUPAC name of N-(2-methoxyethyl)-N,2-dimethylprop-2-enamide (CID 22677235) is N-(2-methoxyethyl)-N,2-dimethylprop-2-enamide.
What is the SMILES notation for N-(2-methoxyethyl)-N,2-dimethylprop-2-enamide?
The canonical SMILES for N-(2-methoxyethyl)-N,2-dimethylprop-2-enamide is C=C(C)C(=O)N(C)CCOC.
What is the InChIKey of N-(2-methoxyethyl)-N,2-dimethylprop-2-enamide?
The InChIKey is LPOBKPYYGMYJAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO2/c1-7(2)8(10)9(3)5-6-11-4/h1,5-6H2,2-4H3.
What are the key properties of N-(2-methoxyethyl)-N,2-dimethylprop-2-enamide?
N-(2-methoxyethyl)-N,2-dimethylprop-2-enamide has a molecular weight of 157.21 g/mol, XLogP of 0.67, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-N,2-dimethylprop-2-enamide is sourced from PubChem (CID 22677235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).