3-(2-ethyl-5-oxopyrrolidin-2-yl)-N-methyl-N-[2-(oxan-2-yl)ethyl]propanamide

C17H30N2O3 — CID 45169089

IUPAC3-(2-ethyl-5-oxopyrrolidin-2-yl)-N-methyl-N-[2-(oxan-2-yl)ethyl]propanamide
SMILESCCC1(CCC(=O)N(C)CCC2CCCCO2)CCC(=O)N1
InChIInChI=1S/C17H30N2O3/c1-3-17(10-7-15(20)18-17)11-8-16(21)19(2)12-9-14-6-4-5-13-22-14/h14H,3-13H2,1-2H3,(H,18,20)
InChIKeyZOLLMDRJYBWNHX-UHFFFAOYSA-N
MW310.44 g/mol
LogP2.24
Rot. Bonds7

About 3-(2-ethyl-5-oxopyrrolidin-2-yl)-N-methyl-N-[2-(oxan-2-yl)ethyl]propanamide

3-(2-ethyl-5-oxopyrrolidin-2-yl)-N-methyl-N-[2-(oxan-2-yl)ethyl]propanamide (PubChem CID 45169089) has the molecular formula C17H30N2O3 and a molecular weight of 310.44 g/mol. Its IUPAC name is 3-(2-ethyl-5-oxopyrrolidin-2-yl)-N-methyl-N-[2-(oxan-2-yl)ethyl]propanamide.

Molecular Properties

Compound Name3-(2-ethyl-5-oxopyrrolidin-2-yl)-N-methyl-N-[2-(oxan-2-yl)ethyl]propanamide
PubChem CID45169089
Molecular FormulaC17H30N2O3
Molecular Weight310.44 g/mol
Exact Mass310.23
IUPAC Name3-(2-ethyl-5-oxopyrrolidin-2-yl)-N-methyl-N-[2-(oxan-2-yl)ethyl]propanamide
SMILESCCC1(CCC(=O)N(C)CCC2CCCCO2)CCC(=O)N1
InChIInChI=1S/C17H30N2O3/c1-3-17(10-7-15(20)18-17)11-8-16(21)19(2)12-9-14-6-4-5-13-22-14/h14H,3-13H2,1-2H3,(H,18,20)
InChIKeyZOLLMDRJYBWNHX-UHFFFAOYSA-N
XLogP2.24
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.44
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-[methyl-[2-[(2S)-oxan-2-yl]ethyl]amino]-5-oxopentanoic acid
CID 126440241
4-(3,4-dimethylphenyl)-N-methyl-N-[2-(oxan-2-yl)ethyl]-4-oxobutanamide
CID 110614236
N-methyl-N-[2-(oxan-2-yl)ethyl]adamantane-1-carboxamide
CID 110604888
1,1,3-trimethyl-3-[2-(oxan-2-yl)ethyl]urea
CID 110604883
N-butyl-N-methyl-3-(oxolan-2-yl)propanamide
CID 86929613
N-(2-hydroxyethyl)-N-methyl-3-(oxolan-2-yl)propanamide
CID 60749979
3-(3-hydroxyphenyl)-N-methyl-N-[2-(oxan-2-yl)ethyl]propanamide
CID 77086969
N-(3-aminopropyl)-N-methyl-3-(oxolan-2-yl)propanamide
CID 65152557
N-methyl-N-[2-(oxan-2-yl)ethyl]-3-(2-pyridin-2-yl-1,3-thiazol-4-yl)propanamide
CID 110614300
N-methyl-N-(oxan-2-ylmethyl)-3-(propan-2-ylamino)propanamide
CID 61436363
methyl 3-[methyl-[3-(oxolan-2-yl)propanoyl]amino]propanoate
CID 54979906
N-methyl-N-[2-(oxan-2-yl)ethyl]-1H-1,2,4-triazole-5-carboxamide
CID 77091135

Frequently Asked Questions

What is the IUPAC name of 3-(2-ethyl-5-oxopyrrolidin-2-yl)-N-methyl-N-[2-(oxan-2-yl)ethyl]propanamide?
The IUPAC name of 3-(2-ethyl-5-oxopyrrolidin-2-yl)-N-methyl-N-[2-(oxan-2-yl)ethyl]propanamide (CID 45169089) is 3-(2-ethyl-5-oxopyrrolidin-2-yl)-N-methyl-N-[2-(oxan-2-yl)ethyl]propanamide.
What is the SMILES notation for 3-(2-ethyl-5-oxopyrrolidin-2-yl)-N-methyl-N-[2-(oxan-2-yl)ethyl]propanamide?
The canonical SMILES for 3-(2-ethyl-5-oxopyrrolidin-2-yl)-N-methyl-N-[2-(oxan-2-yl)ethyl]propanamide is CCC1(CCC(=O)N(C)CCC2CCCCO2)CCC(=O)N1.
What is the InChIKey of 3-(2-ethyl-5-oxopyrrolidin-2-yl)-N-methyl-N-[2-(oxan-2-yl)ethyl]propanamide?
The InChIKey is ZOLLMDRJYBWNHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H30N2O3/c1-3-17(10-7-15(20)18-17)11-8-16(21)19(2)12-9-14-6-4-5-13-22-14/h14H,3-13H2,1-2H3,(H,18,20).
What are the key properties of 3-(2-ethyl-5-oxopyrrolidin-2-yl)-N-methyl-N-[2-(oxan-2-yl)ethyl]propanamide?
3-(2-ethyl-5-oxopyrrolidin-2-yl)-N-methyl-N-[2-(oxan-2-yl)ethyl]propanamide has a molecular weight of 310.44 g/mol, XLogP of 2.24, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-ethyl-5-oxopyrrolidin-2-yl)-N-methyl-N-[2-(oxan-2-yl)ethyl]propanamide is sourced from PubChem (CID 45169089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).