2-(dimethylamino)ethyl 2-ethoxy-2,2-diphenylacetate

C20H25NO3 — CID 17036

💊View drug profile → dimenoxadol
IUPAC2-(dimethylamino)ethyl 2-ethoxy-2,2-diphenylacetate
SMILESCCOC(C(=O)OCCN(C)C)(c1ccccc1)c1ccccc1
InChIInChI=1S/C20H25NO3/c1-4-24-20(17-11-7-5-8-12-17,18-13-9-6-10-14-18)19(22)23-16-15-21(2)3/h5-14H,4,15-16H2,1-3H3
InChIKeyRHUWRJWFHUKVED-UHFFFAOYSA-N
MW327.42 g/mol
LogP3.07
Rot. Bonds8

About 2-(dimethylamino)ethyl 2-ethoxy-2,2-diphenylacetate

2-(dimethylamino)ethyl 2-ethoxy-2,2-diphenylacetate (PubChem CID 17036) has the molecular formula C20H25NO3 and a molecular weight of 327.42 g/mol. Its IUPAC name is 2-(dimethylamino)ethyl 2-ethoxy-2,2-diphenylacetate.

Molecular Properties

Compound Name2-(dimethylamino)ethyl 2-ethoxy-2,2-diphenylacetate
PubChem CID17036
Molecular FormulaC20H25NO3
Molecular Weight327.42 g/mol
Exact Mass327.18
IUPAC Name2-(dimethylamino)ethyl 2-ethoxy-2,2-diphenylacetate
SMILESCCOC(C(=O)OCCN(C)C)(c1ccccc1)c1ccccc1
InChIInChI=1S/C20H25NO3/c1-4-24-20(17-11-7-5-8-12-17,18-13-9-6-10-14-18)19(22)23-16-15-21(2)3/h5-14H,4,15-16H2,1-3H3
InChIKeyRHUWRJWFHUKVED-UHFFFAOYSA-N
XLogP3.07
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.42
LogP ≤ 53.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 2-(dimethylamino)ethyl 2-ethoxy-2,2-diphenylacetate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Benactyzine
CID 9330
Oxybutynin
CID 4634
Adiphenine
CID 2031
Mepenzolate
CID 4057
Propiverine
CID 4942
Oxyphenonium
CID 5749
Oxyphenonium Bromide
CID 5748
Pipenzolate
CID 4832
Aprofene
CID 71128
Benactyzine Hydrochloride
CID 66448
Proadifen
CID 4910
Fenbutrazate
CID 20395

Frequently Asked Questions

What is the IUPAC name of 2-(dimethylamino)ethyl 2-ethoxy-2,2-diphenylacetate?
The IUPAC name of 2-(dimethylamino)ethyl 2-ethoxy-2,2-diphenylacetate (CID 17036) is 2-(dimethylamino)ethyl 2-ethoxy-2,2-diphenylacetate.
What is the SMILES notation for 2-(dimethylamino)ethyl 2-ethoxy-2,2-diphenylacetate?
The canonical SMILES for 2-(dimethylamino)ethyl 2-ethoxy-2,2-diphenylacetate is CCOC(C(=O)OCCN(C)C)(c1ccccc1)c1ccccc1.
What is the InChIKey of 2-(dimethylamino)ethyl 2-ethoxy-2,2-diphenylacetate?
The InChIKey is RHUWRJWFHUKVED-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25NO3/c1-4-24-20(17-11-7-5-8-12-17,18-13-9-6-10-14-18)19(22)23-16-15-21(2)3/h5-14H,4,15-16H2,1-3H3.
What are the key properties of 2-(dimethylamino)ethyl 2-ethoxy-2,2-diphenylacetate?
2-(dimethylamino)ethyl 2-ethoxy-2,2-diphenylacetate has a molecular weight of 327.42 g/mol, XLogP of 3.07, 8 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dimethylamino)ethyl 2-ethoxy-2,2-diphenylacetate is sourced from PubChem (CID 17036), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).