N-ethyl-N-(2-methoxyethyl)prop-2-enamide

C8H15NO2 — CID 14847594

IUPACN-ethyl-N-(2-methoxyethyl)prop-2-enamide
SMILESC=CC(=O)N(CC)CCOC
InChIInChI=1S/C8H15NO2/c1-4-8(10)9(5-2)6-7-11-3/h4H,1,5-7H2,2-3H3
InChIKeyRPJRWEYHCYPVJY-UHFFFAOYSA-N
MW157.21 g/mol
LogP0.67
Rot. Bonds5

About N-ethyl-N-(2-methoxyethyl)prop-2-enamide

N-ethyl-N-(2-methoxyethyl)prop-2-enamide (PubChem CID 14847594) has the molecular formula C8H15NO2 and a molecular weight of 157.21 g/mol. Its IUPAC name is N-ethyl-N-(2-methoxyethyl)prop-2-enamide.

Molecular Properties

Compound NameN-ethyl-N-(2-methoxyethyl)prop-2-enamide
PubChem CID14847594
Molecular FormulaC8H15NO2
Molecular Weight157.21 g/mol
Exact Mass157.11
IUPAC NameN-ethyl-N-(2-methoxyethyl)prop-2-enamide
SMILESC=CC(=O)N(CC)CCOC
InChIInChI=1S/C8H15NO2/c1-4-8(10)9(5-2)6-7-11-3/h4H,1,5-7H2,2-3H3
InChIKeyRPJRWEYHCYPVJY-UHFFFAOYSA-N
XLogP0.67
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
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-ethyl-N-(2-methoxyethyl)prop-2-enamide?
The IUPAC name of N-ethyl-N-(2-methoxyethyl)prop-2-enamide (CID 14847594) is N-ethyl-N-(2-methoxyethyl)prop-2-enamide.
What is the SMILES notation for N-ethyl-N-(2-methoxyethyl)prop-2-enamide?
The canonical SMILES for N-ethyl-N-(2-methoxyethyl)prop-2-enamide is C=CC(=O)N(CC)CCOC.
What is the InChIKey of N-ethyl-N-(2-methoxyethyl)prop-2-enamide?
The InChIKey is RPJRWEYHCYPVJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO2/c1-4-8(10)9(5-2)6-7-11-3/h4H,1,5-7H2,2-3H3.
What are the key properties of N-ethyl-N-(2-methoxyethyl)prop-2-enamide?
N-ethyl-N-(2-methoxyethyl)prop-2-enamide has a molecular weight of 157.21 g/mol, XLogP of 0.67, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(2-methoxyethyl)prop-2-enamide is sourced from PubChem (CID 14847594), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).