3-ethoxy-N-(2-hydroxyethyl)-N-prop-2-enylpropanamide

C10H19NO3 — CID 115775879

IUPAC3-ethoxy-N-(2-hydroxyethyl)-N-prop-2-enylpropanamide
SMILESC=CCN(CCO)C(=O)CCOCC
InChIInChI=1S/C10H19NO3/c1-3-6-11(7-8-12)10(13)5-9-14-4-2/h3,12H,1,4-9H2,2H3
InChIKeyBDYCMTUBJCQKKE-UHFFFAOYSA-N
MW201.27 g/mol
LogP0.42
Rot. Bonds8

About 3-ethoxy-N-(2-hydroxyethyl)-N-prop-2-enylpropanamide

3-ethoxy-N-(2-hydroxyethyl)-N-prop-2-enylpropanamide (PubChem CID 115775879) has the molecular formula C10H19NO3 and a molecular weight of 201.27 g/mol. Its IUPAC name is 3-ethoxy-N-(2-hydroxyethyl)-N-prop-2-enylpropanamide.

Molecular Properties

Compound Name3-ethoxy-N-(2-hydroxyethyl)-N-prop-2-enylpropanamide
PubChem CID115775879
Molecular FormulaC10H19NO3
Molecular Weight201.27 g/mol
Exact Mass201.14
IUPAC Name3-ethoxy-N-(2-hydroxyethyl)-N-prop-2-enylpropanamide
SMILESC=CCN(CCO)C(=O)CCOCC
InChIInChI=1S/C10H19NO3/c1-3-6-11(7-8-12)10(13)5-9-14-4-2/h3,12H,1,4-9H2,2H3
InChIKeyBDYCMTUBJCQKKE-UHFFFAOYSA-N
XLogP0.42
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.27
LogP ≤ 50.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

4-ethoxy-N-(2-hydroxyethyl)-N-prop-2-enylbutanamide
CID 115775753
2-ethoxy-N-(2-hydroxyethyl)-N-prop-2-enylacetamide
CID 115775668
N-(2-hydroxyethyl)-N-prop-2-enylpent-4-enamide
CID 115775480
N-(2-hydroxyethyl)-N-prop-2-enylacetamide
CID 84572947
3-(2-fluorophenoxy)-N-(2-hydroxyethyl)-N-prop-2-enylpropanamide
CID 115775553
N-[3-[2-hydroxyethyl(prop-2-enyl)amino]-3-oxopropyl]-2,2-dimethylpropanamide
CID 115775603
N-ethyl-N-(2-hydroxyethyl)pent-4-enamide
CID 62678717
N-(2-hydroxyethyl)-N-(2-methoxyethyl)pent-4-enamide
CID 115772576
2-[2-[bis(prop-2-enyl)amino]-2-oxoethoxy]-N-ethyl-N-prop-2-enylacetamide
CID 166930748
5-bromo-N-(2-methoxyethyl)-N-prop-2-enylpentanamide
CID 107910751
4-chloro-N-(2-methoxyethyl)-N-prop-2-enylbutanamide
CID 103338580
N-(2-hydroxyethyl)-2-(2-methylphenoxy)-N-prop-2-enylacetamide
CID 113340576

Frequently Asked Questions

What is the IUPAC name of 3-ethoxy-N-(2-hydroxyethyl)-N-prop-2-enylpropanamide?
The IUPAC name of 3-ethoxy-N-(2-hydroxyethyl)-N-prop-2-enylpropanamide (CID 115775879) is 3-ethoxy-N-(2-hydroxyethyl)-N-prop-2-enylpropanamide.
What is the SMILES notation for 3-ethoxy-N-(2-hydroxyethyl)-N-prop-2-enylpropanamide?
The canonical SMILES for 3-ethoxy-N-(2-hydroxyethyl)-N-prop-2-enylpropanamide is C=CCN(CCO)C(=O)CCOCC.
What is the InChIKey of 3-ethoxy-N-(2-hydroxyethyl)-N-prop-2-enylpropanamide?
The InChIKey is BDYCMTUBJCQKKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO3/c1-3-6-11(7-8-12)10(13)5-9-14-4-2/h3,12H,1,4-9H2,2H3.
What are the key properties of 3-ethoxy-N-(2-hydroxyethyl)-N-prop-2-enylpropanamide?
3-ethoxy-N-(2-hydroxyethyl)-N-prop-2-enylpropanamide has a molecular weight of 201.27 g/mol, XLogP of 0.42, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethoxy-N-(2-hydroxyethyl)-N-prop-2-enylpropanamide is sourced from PubChem (CID 115775879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).