N-[2-(diethylamino)-2-(furan-2-yl)ethyl]-2-[2-(2-methylphenyl)pyrrolidin-1-yl]acetamide

C23H33N3O2 — CID 55828169

IUPACN-[2-(diethylamino)-2-(furan-2-yl)ethyl]-2-[2-(2-methylphenyl)pyrrolidin-1-yl]acetamide
SMILESCCN(CC)C(CNC(=O)CN1CCCC1c1ccccc1C)c1ccco1
InChIInChI=1S/C23H33N3O2/c1-4-25(5-2)21(22-13-9-15-28-22)16-24-23(27)17-26-14-8-12-20(26)19-11-7-6-10-18(19)3/h6-7,9-11,13,15,20-21H,4-5,8,12,14,16-17H2,1-3H3,(H,24,27)
InChIKeyGTACUICNAVQEML-UHFFFAOYSA-N
MW383.54 g/mol
LogP3.92
Rot. Bonds9

About N-[2-(diethylamino)-2-(furan-2-yl)ethyl]-2-[2-(2-methylphenyl)pyrrolidin-1-yl]acetamide

N-[2-(diethylamino)-2-(furan-2-yl)ethyl]-2-[2-(2-methylphenyl)pyrrolidin-1-yl]acetamide (PubChem CID 55828169) has the molecular formula C23H33N3O2 and a molecular weight of 383.54 g/mol. Its IUPAC name is N-[2-(diethylamino)-2-(furan-2-yl)ethyl]-2-[2-(2-methylphenyl)pyrrolidin-1-yl]acetamide.

Molecular Properties

Compound NameN-[2-(diethylamino)-2-(furan-2-yl)ethyl]-2-[2-(2-methylphenyl)pyrrolidin-1-yl]acetamide
PubChem CID55828169
Molecular FormulaC23H33N3O2
Molecular Weight383.54 g/mol
Exact Mass383.26
IUPAC NameN-[2-(diethylamino)-2-(furan-2-yl)ethyl]-2-[2-(2-methylphenyl)pyrrolidin-1-yl]acetamide
SMILESCCN(CC)C(CNC(=O)CN1CCCC1c1ccccc1C)c1ccco1
InChIInChI=1S/C23H33N3O2/c1-4-25(5-2)21(22-13-9-15-28-22)16-24-23(27)17-26-14-8-12-20(26)19-11-7-6-10-18(19)3/h6-7,9-11,13,15,20-21H,4-5,8,12,14,16-17H2,1-3H3,(H,24,27)
InChIKeyGTACUICNAVQEML-UHFFFAOYSA-N
XLogP3.92
TPSA48.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.54
LogP ≤ 53.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[4-[2-[[2-(diethylamino)-2-(furan-2-yl)ethyl]amino]-2-oxoethyl]piperazin-1-yl]-N-ethylacetamide
CID 55823292
2-[2-(2-methylphenyl)pyrrolidin-1-yl]-N-(thiophen-2-ylmethyl)acetamide
CID 60505182
ethyl 1-[N-[2-(diethylamino)-2-(furan-2-yl)ethyl]-N'-methylcarbamimidoyl]piperidine-4-carboxylate
CID 111155136
N-[2-(diethylamino)-2-(furan-2-yl)ethyl]-3-(2,5-dioxopyrrolidin-1-yl)propanamide
CID 51095697
N-[(2R)-2-(diethylamino)-2-(furan-2-yl)ethyl]-3-(2,5-dioxopyrrolidin-1-yl)propanamide
CID 94819543
N-[2-(diethylamino)-2-(furan-2-yl)ethyl]-N',4-dimethylpiperidine-1-carboximidamide
CID 111210893
N-[(2S)-2-(diethylamino)-2-(furan-2-yl)ethyl]-3-(1,3,5-trimethylpyrazol-4-yl)propanamide
CID 94824014
N-[(2S)-2-(diethylamino)-2-(furan-2-yl)ethyl]-2-[(3S)-1,1-dioxothiolan-3-yl]sulfanylacetamide
CID 52524946
tert-butyl N-[1-[N-[2-(diethylamino)-2-(furan-2-yl)ethyl]-N'-methylcarbamimidoyl]pyrrolidin-3-yl]carbamate;hydroiodide
CID 111730694
N-[2-(diethylamino)-2-(furan-2-yl)ethyl]-2-(4-ethoxyphenyl)sulfanylacetamide
CID 55462976
N-[2-(diethylamino)-2-(furan-2-yl)ethyl]-2-(2,4,4-trimethylpentan-2-ylamino)acetamide
CID 71933658
N-(4-ethyl-4-methyl-2,5-dioxoimidazolidin-1-yl)-2-[2-(2-methylphenyl)pyrrolidin-1-yl]acetamide
CID 55828676

Frequently Asked Questions

What is the IUPAC name of N-[2-(diethylamino)-2-(furan-2-yl)ethyl]-2-[2-(2-methylphenyl)pyrrolidin-1-yl]acetamide?
The IUPAC name of N-[2-(diethylamino)-2-(furan-2-yl)ethyl]-2-[2-(2-methylphenyl)pyrrolidin-1-yl]acetamide (CID 55828169) is N-[2-(diethylamino)-2-(furan-2-yl)ethyl]-2-[2-(2-methylphenyl)pyrrolidin-1-yl]acetamide.
What is the SMILES notation for N-[2-(diethylamino)-2-(furan-2-yl)ethyl]-2-[2-(2-methylphenyl)pyrrolidin-1-yl]acetamide?
The canonical SMILES for N-[2-(diethylamino)-2-(furan-2-yl)ethyl]-2-[2-(2-methylphenyl)pyrrolidin-1-yl]acetamide is CCN(CC)C(CNC(=O)CN1CCCC1c1ccccc1C)c1ccco1.
What is the InChIKey of N-[2-(diethylamino)-2-(furan-2-yl)ethyl]-2-[2-(2-methylphenyl)pyrrolidin-1-yl]acetamide?
The InChIKey is GTACUICNAVQEML-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H33N3O2/c1-4-25(5-2)21(22-13-9-15-28-22)16-24-23(27)17-26-14-8-12-20(26)19-11-7-6-10-18(19)3/h6-7,9-11,13,15,20-21H,4-5,8,12,14,16-17H2,1-3H3,(H,24,27).
What are the key properties of N-[2-(diethylamino)-2-(furan-2-yl)ethyl]-2-[2-(2-methylphenyl)pyrrolidin-1-yl]acetamide?
N-[2-(diethylamino)-2-(furan-2-yl)ethyl]-2-[2-(2-methylphenyl)pyrrolidin-1-yl]acetamide has a molecular weight of 383.54 g/mol, XLogP of 3.92, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(diethylamino)-2-(furan-2-yl)ethyl]-2-[2-(2-methylphenyl)pyrrolidin-1-yl]acetamide is sourced from PubChem (CID 55828169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).