2-(diethylamino)-N-[[2-(ethoxymethyl)phenyl]methyl]-2-phenylacetamide

C22H30N2O2 — CID 56540663

IUPAC2-(diethylamino)-N-[[2-(ethoxymethyl)phenyl]methyl]-2-phenylacetamide
SMILESCCOCc1ccccc1CNC(=O)C(c1ccccc1)N(CC)CC
InChIInChI=1S/C22H30N2O2/c1-4-24(5-2)21(18-12-8-7-9-13-18)22(25)23-16-19-14-10-11-15-20(19)17-26-6-3/h7-15,21H,4-6,16-17H2,1-3H3,(H,23,25)
InChIKeyIQLJLWNIWHDQBI-UHFFFAOYSA-N
MW354.49 g/mol
LogP3.92
Rot. Bonds10

About 2-(diethylamino)-N-[[2-(ethoxymethyl)phenyl]methyl]-2-phenylacetamide

2-(diethylamino)-N-[[2-(ethoxymethyl)phenyl]methyl]-2-phenylacetamide (PubChem CID 56540663) has the molecular formula C22H30N2O2 and a molecular weight of 354.49 g/mol. Its IUPAC name is 2-(diethylamino)-N-[[2-(ethoxymethyl)phenyl]methyl]-2-phenylacetamide.

Molecular Properties

Compound Name2-(diethylamino)-N-[[2-(ethoxymethyl)phenyl]methyl]-2-phenylacetamide
PubChem CID56540663
Molecular FormulaC22H30N2O2
Molecular Weight354.49 g/mol
Exact Mass354.23
IUPAC Name2-(diethylamino)-N-[[2-(ethoxymethyl)phenyl]methyl]-2-phenylacetamide
SMILESCCOCc1ccccc1CNC(=O)C(c1ccccc1)N(CC)CC
InChIInChI=1S/C22H30N2O2/c1-4-24(5-2)21(18-12-8-7-9-13-18)22(25)23-16-19-14-10-11-15-20(19)17-26-6-3/h7-15,21H,4-6,16-17H2,1-3H3,(H,23,25)
InChIKeyIQLJLWNIWHDQBI-UHFFFAOYSA-N
XLogP3.92
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.49
LogP ≤ 53.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(diethylamino)-N-[[2-(ethoxymethyl)phenyl]methyl]-2-phenylacetamide?
The IUPAC name of 2-(diethylamino)-N-[[2-(ethoxymethyl)phenyl]methyl]-2-phenylacetamide (CID 56540663) is 2-(diethylamino)-N-[[2-(ethoxymethyl)phenyl]methyl]-2-phenylacetamide.
What is the SMILES notation for 2-(diethylamino)-N-[[2-(ethoxymethyl)phenyl]methyl]-2-phenylacetamide?
The canonical SMILES for 2-(diethylamino)-N-[[2-(ethoxymethyl)phenyl]methyl]-2-phenylacetamide is CCOCc1ccccc1CNC(=O)C(c1ccccc1)N(CC)CC.
What is the InChIKey of 2-(diethylamino)-N-[[2-(ethoxymethyl)phenyl]methyl]-2-phenylacetamide?
The InChIKey is IQLJLWNIWHDQBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H30N2O2/c1-4-24(5-2)21(18-12-8-7-9-13-18)22(25)23-16-19-14-10-11-15-20(19)17-26-6-3/h7-15,21H,4-6,16-17H2,1-3H3,(H,23,25).
What are the key properties of 2-(diethylamino)-N-[[2-(ethoxymethyl)phenyl]methyl]-2-phenylacetamide?
2-(diethylamino)-N-[[2-(ethoxymethyl)phenyl]methyl]-2-phenylacetamide has a molecular weight of 354.49 g/mol, XLogP of 3.92, 10 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(diethylamino)-N-[[2-(ethoxymethyl)phenyl]methyl]-2-phenylacetamide is sourced from PubChem (CID 56540663), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).