2-(diethylamino)-N-(4-hydroxyphenyl)-N-methylacetamide

C13H20N2O2 — CID 19229

IUPAC2-(diethylamino)-N-(4-hydroxyphenyl)-N-methylacetamide
SMILESCCN(CC)CC(=O)N(C)c1ccc(O)cc1
InChIInChI=1S/C13H20N2O2/c1-4-15(5-2)10-13(17)14(3)11-6-8-12(16)9-7-11/h6-9,16H,4-5,10H2,1-3H3
InChIKeyDBEJOBUYQSPUMS-UHFFFAOYSA-N
MW236.31 g/mol
LogP1.70
Rot. Bonds5

About 2-(diethylamino)-N-(4-hydroxyphenyl)-N-methylacetamide

2-(diethylamino)-N-(4-hydroxyphenyl)-N-methylacetamide (PubChem CID 19229) has the molecular formula C13H20N2O2 and a molecular weight of 236.31 g/mol. Its IUPAC name is 2-(diethylamino)-N-(4-hydroxyphenyl)-N-methylacetamide.

Molecular Properties

Compound Name2-(diethylamino)-N-(4-hydroxyphenyl)-N-methylacetamide
PubChem CID19229
Molecular FormulaC13H20N2O2
Molecular Weight236.31 g/mol
Exact Mass236.15
IUPAC Name2-(diethylamino)-N-(4-hydroxyphenyl)-N-methylacetamide
SMILESCCN(CC)CC(=O)N(C)c1ccc(O)cc1
InChIInChI=1S/C13H20N2O2/c1-4-15(5-2)10-13(17)14(3)11-6-8-12(16)9-7-11/h6-9,16H,4-5,10H2,1-3H3
InChIKeyDBEJOBUYQSPUMS-UHFFFAOYSA-N
XLogP1.70
TPSA43.78 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.31
LogP ≤ 51.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(diethylamino)-N-(4-hydroxyphenyl)-N-methylacetamide?
The IUPAC name of 2-(diethylamino)-N-(4-hydroxyphenyl)-N-methylacetamide (CID 19229) is 2-(diethylamino)-N-(4-hydroxyphenyl)-N-methylacetamide.
What is the SMILES notation for 2-(diethylamino)-N-(4-hydroxyphenyl)-N-methylacetamide?
The canonical SMILES for 2-(diethylamino)-N-(4-hydroxyphenyl)-N-methylacetamide is CCN(CC)CC(=O)N(C)c1ccc(O)cc1.
What is the InChIKey of 2-(diethylamino)-N-(4-hydroxyphenyl)-N-methylacetamide?
The InChIKey is DBEJOBUYQSPUMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O2/c1-4-15(5-2)10-13(17)14(3)11-6-8-12(16)9-7-11/h6-9,16H,4-5,10H2,1-3H3.
What are the key properties of 2-(diethylamino)-N-(4-hydroxyphenyl)-N-methylacetamide?
2-(diethylamino)-N-(4-hydroxyphenyl)-N-methylacetamide has a molecular weight of 236.31 g/mol, XLogP of 1.70, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(diethylamino)-N-(4-hydroxyphenyl)-N-methylacetamide is sourced from PubChem (CID 19229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).