3-(5-amino-2,4-dimethoxyphenyl)-N-ethyl-N-(2-hydroxyethyl)propanamide

C15H24N2O4 — CID 82183862

IUPAC3-(5-amino-2,4-dimethoxyphenyl)-N-ethyl-N-(2-hydroxyethyl)propanamide
SMILESCCN(CCO)C(=O)CCc1cc(N)c(OC)cc1OC
InChIInChI=1S/C15H24N2O4/c1-4-17(7-8-18)15(19)6-5-11-9-12(16)14(21-3)10-13(11)20-2/h9-10,18H,4-8,16H2,1-3H3
InChIKeyLUFRNWIMGDHASE-UHFFFAOYSA-N
MW296.37 g/mol
LogP1.06
Rot. Bonds8

About 3-(5-amino-2,4-dimethoxyphenyl)-N-ethyl-N-(2-hydroxyethyl)propanamide

3-(5-amino-2,4-dimethoxyphenyl)-N-ethyl-N-(2-hydroxyethyl)propanamide (PubChem CID 82183862) has the molecular formula C15H24N2O4 and a molecular weight of 296.37 g/mol. Its IUPAC name is 3-(5-amino-2,4-dimethoxyphenyl)-N-ethyl-N-(2-hydroxyethyl)propanamide.

Molecular Properties

Compound Name3-(5-amino-2,4-dimethoxyphenyl)-N-ethyl-N-(2-hydroxyethyl)propanamide
PubChem CID82183862
Molecular FormulaC15H24N2O4
Molecular Weight296.37 g/mol
Exact Mass296.17
IUPAC Name3-(5-amino-2,4-dimethoxyphenyl)-N-ethyl-N-(2-hydroxyethyl)propanamide
SMILESCCN(CCO)C(=O)CCc1cc(N)c(OC)cc1OC
InChIInChI=1S/C15H24N2O4/c1-4-17(7-8-18)15(19)6-5-11-9-12(16)14(21-3)10-13(11)20-2/h9-10,18H,4-8,16H2,1-3H3
InChIKeyLUFRNWIMGDHASE-UHFFFAOYSA-N
XLogP1.06
TPSA85.02 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.37
LogP ≤ 51.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3-(5-amino-2,4-dimethoxyphenyl)-N-ethyl-N-(2-hydroxyethyl)propanamide?
The IUPAC name of 3-(5-amino-2,4-dimethoxyphenyl)-N-ethyl-N-(2-hydroxyethyl)propanamide (CID 82183862) is 3-(5-amino-2,4-dimethoxyphenyl)-N-ethyl-N-(2-hydroxyethyl)propanamide.
What is the SMILES notation for 3-(5-amino-2,4-dimethoxyphenyl)-N-ethyl-N-(2-hydroxyethyl)propanamide?
The canonical SMILES for 3-(5-amino-2,4-dimethoxyphenyl)-N-ethyl-N-(2-hydroxyethyl)propanamide is CCN(CCO)C(=O)CCc1cc(N)c(OC)cc1OC.
What is the InChIKey of 3-(5-amino-2,4-dimethoxyphenyl)-N-ethyl-N-(2-hydroxyethyl)propanamide?
The InChIKey is LUFRNWIMGDHASE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O4/c1-4-17(7-8-18)15(19)6-5-11-9-12(16)14(21-3)10-13(11)20-2/h9-10,18H,4-8,16H2,1-3H3.
What are the key properties of 3-(5-amino-2,4-dimethoxyphenyl)-N-ethyl-N-(2-hydroxyethyl)propanamide?
3-(5-amino-2,4-dimethoxyphenyl)-N-ethyl-N-(2-hydroxyethyl)propanamide has a molecular weight of 296.37 g/mol, XLogP of 1.06, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-amino-2,4-dimethoxyphenyl)-N-ethyl-N-(2-hydroxyethyl)propanamide is sourced from PubChem (CID 82183862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).