2-[3-(3,5-dimethoxyphenyl)pyrrolidin-1-yl]-N-ethylacetamide

C16H24N2O3 — CID 71923204

IUPAC2-[3-(3,5-dimethoxyphenyl)pyrrolidin-1-yl]-N-ethylacetamide
SMILESCCNC(=O)CN1CCC(c2cc(OC)cc(OC)c2)C1
InChIInChI=1S/C16H24N2O3/c1-4-17-16(19)11-18-6-5-12(10-18)13-7-14(20-2)9-15(8-13)21-3/h7-9,12H,4-6,10-11H2,1-3H3,(H,17,19)
InChIKeyHLWFPXALPLXIRG-UHFFFAOYSA-N
MW292.38 g/mol
LogP1.63
Rot. Bonds6

About 2-[3-(3,5-dimethoxyphenyl)pyrrolidin-1-yl]-N-ethylacetamide

2-[3-(3,5-dimethoxyphenyl)pyrrolidin-1-yl]-N-ethylacetamide (PubChem CID 71923204) has the molecular formula C16H24N2O3 and a molecular weight of 292.38 g/mol. Its IUPAC name is 2-[3-(3,5-dimethoxyphenyl)pyrrolidin-1-yl]-N-ethylacetamide.

Molecular Properties

Compound Name2-[3-(3,5-dimethoxyphenyl)pyrrolidin-1-yl]-N-ethylacetamide
PubChem CID71923204
Molecular FormulaC16H24N2O3
Molecular Weight292.38 g/mol
Exact Mass292.18
IUPAC Name2-[3-(3,5-dimethoxyphenyl)pyrrolidin-1-yl]-N-ethylacetamide
SMILESCCNC(=O)CN1CCC(c2cc(OC)cc(OC)c2)C1
InChIInChI=1S/C16H24N2O3/c1-4-17-16(19)11-18-6-5-12(10-18)13-7-14(20-2)9-15(8-13)21-3/h7-9,12H,4-6,10-11H2,1-3H3,(H,17,19)
InChIKeyHLWFPXALPLXIRG-UHFFFAOYSA-N
XLogP1.63
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-[3-(3,5-dimethoxyphenyl)pyrrolidin-1-yl]-N-ethylacetamide 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

2-[3-(4-methoxyphenyl)pyrrolidin-1-yl]-N-prop-2-enylacetamide
CID 51103994
N-ethyl-2-[3-(5-methoxypyrimidin-2-yl)oxypyrrolidin-1-yl]acetamide
CID 163350806
N-[(4-fluorophenyl)methyl]-2-[3-(4-methoxyphenyl)pyrrolidin-1-yl]acetamide
CID 136580152
2-[(3R)-3-(4-methoxyphenyl)pyrrolidin-1-yl]-N-(methylcarbamoyl)acetamide
CID 94797807
N-[2-(4-methoxyphenyl)ethyl]-2-[(3R)-3-phenylpyrrolidin-1-yl]acetamide
CID 95313734
2-(3-phenylpyrrolidin-1-yl)-N-[(2,4,5-trimethoxyphenyl)methyl]acetamide
CID 60603605
2-(3-phenylpyrrolidin-1-yl)-N-prop-2-ynylacetamide
CID 78983867
1-[2-(ethylamino)-2-oxoethyl]pyrrolidine-3-carboxylic acid
CID 22322835
2-[3-(methylamino)piperidin-1-yl]-N-[(2,4,6-trimethoxyphenyl)methyl]acetamide
CID 119920099
2-[4-(4-methoxyphenyl)piperidin-1-yl]-N-prop-2-enylacetamide
CID 16667986
N-(3-methoxypropyl)-2-[(3R)-3-phenylpyrrolidin-1-yl]acetamide
CID 95147881
N-ethyl-2-[4-(3-methoxyphenyl)piperazin-1-yl]acetamide
CID 78787987

Frequently Asked Questions

What is the IUPAC name of 2-[3-(3,5-dimethoxyphenyl)pyrrolidin-1-yl]-N-ethylacetamide?
The IUPAC name of 2-[3-(3,5-dimethoxyphenyl)pyrrolidin-1-yl]-N-ethylacetamide (CID 71923204) is 2-[3-(3,5-dimethoxyphenyl)pyrrolidin-1-yl]-N-ethylacetamide.
What is the SMILES notation for 2-[3-(3,5-dimethoxyphenyl)pyrrolidin-1-yl]-N-ethylacetamide?
The canonical SMILES for 2-[3-(3,5-dimethoxyphenyl)pyrrolidin-1-yl]-N-ethylacetamide is CCNC(=O)CN1CCC(c2cc(OC)cc(OC)c2)C1.
What is the InChIKey of 2-[3-(3,5-dimethoxyphenyl)pyrrolidin-1-yl]-N-ethylacetamide?
The InChIKey is HLWFPXALPLXIRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O3/c1-4-17-16(19)11-18-6-5-12(10-18)13-7-14(20-2)9-15(8-13)21-3/h7-9,12H,4-6,10-11H2,1-3H3,(H,17,19).
What are the key properties of 2-[3-(3,5-dimethoxyphenyl)pyrrolidin-1-yl]-N-ethylacetamide?
2-[3-(3,5-dimethoxyphenyl)pyrrolidin-1-yl]-N-ethylacetamide has a molecular weight of 292.38 g/mol, XLogP of 1.63, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(3,5-dimethoxyphenyl)pyrrolidin-1-yl]-N-ethylacetamide is sourced from PubChem (CID 71923204), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).