(2S)-N-[[1-(ethoxymethyl)cyclobutyl]methyl]-2-(2-oxopyrrolidin-1-yl)propanamide

C15H26N2O3 — CID 125441691

IUPAC(2S)-N-[[1-(ethoxymethyl)cyclobutyl]methyl]-2-(2-oxopyrrolidin-1-yl)propanamide
SMILESCCOCC1(CNC(=O)[C@H](C)N2CCCC2=O)CCC1
InChIInChI=1S/C15H26N2O3/c1-3-20-11-15(7-5-8-15)10-16-14(19)12(2)17-9-4-6-13(17)18/h12H,3-11H2,1-2H3,(H,16,19)/t12-/m0/s1
InChIKeyVWEFNEAKVBYTST-LBPRGKRZSA-N
MW282.38 g/mol
LogP1.32
Rot. Bonds7

About (2S)-N-[[1-(ethoxymethyl)cyclobutyl]methyl]-2-(2-oxopyrrolidin-1-yl)propanamide

(2S)-N-[[1-(ethoxymethyl)cyclobutyl]methyl]-2-(2-oxopyrrolidin-1-yl)propanamide (PubChem CID 125441691) has the molecular formula C15H26N2O3 and a molecular weight of 282.38 g/mol. Its IUPAC name is (2S)-N-[[1-(ethoxymethyl)cyclobutyl]methyl]-2-(2-oxopyrrolidin-1-yl)propanamide.

Molecular Properties

Compound Name(2S)-N-[[1-(ethoxymethyl)cyclobutyl]methyl]-2-(2-oxopyrrolidin-1-yl)propanamide
PubChem CID125441691
Molecular FormulaC15H26N2O3
Molecular Weight282.38 g/mol
Exact Mass282.19
IUPAC Name(2S)-N-[[1-(ethoxymethyl)cyclobutyl]methyl]-2-(2-oxopyrrolidin-1-yl)propanamide
SMILESCCOCC1(CNC(=O)[C@H](C)N2CCCC2=O)CCC1
InChIInChI=1S/C15H26N2O3/c1-3-20-11-15(7-5-8-15)10-16-14(19)12(2)17-9-4-6-13(17)18/h12H,3-11H2,1-2H3,(H,16,19)/t12-/m0/s1
InChIKeyVWEFNEAKVBYTST-LBPRGKRZSA-N
XLogP1.32
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.38
LogP ≤ 51.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2S)-N-[[1-(ethoxymethyl)cyclobutyl]methyl]-2-(2-oxopyrrolidin-1-yl)propanamide?
The IUPAC name of (2S)-N-[[1-(ethoxymethyl)cyclobutyl]methyl]-2-(2-oxopyrrolidin-1-yl)propanamide (CID 125441691) is (2S)-N-[[1-(ethoxymethyl)cyclobutyl]methyl]-2-(2-oxopyrrolidin-1-yl)propanamide.
What is the SMILES notation for (2S)-N-[[1-(ethoxymethyl)cyclobutyl]methyl]-2-(2-oxopyrrolidin-1-yl)propanamide?
The canonical SMILES for (2S)-N-[[1-(ethoxymethyl)cyclobutyl]methyl]-2-(2-oxopyrrolidin-1-yl)propanamide is CCOCC1(CNC(=O)[C@H](C)N2CCCC2=O)CCC1.
What is the InChIKey of (2S)-N-[[1-(ethoxymethyl)cyclobutyl]methyl]-2-(2-oxopyrrolidin-1-yl)propanamide?
The InChIKey is VWEFNEAKVBYTST-LBPRGKRZSA-N. The full InChI is InChI=1S/C15H26N2O3/c1-3-20-11-15(7-5-8-15)10-16-14(19)12(2)17-9-4-6-13(17)18/h12H,3-11H2,1-2H3,(H,16,19)/t12-/m0/s1.
What are the key properties of (2S)-N-[[1-(ethoxymethyl)cyclobutyl]methyl]-2-(2-oxopyrrolidin-1-yl)propanamide?
(2S)-N-[[1-(ethoxymethyl)cyclobutyl]methyl]-2-(2-oxopyrrolidin-1-yl)propanamide has a molecular weight of 282.38 g/mol, XLogP of 1.32, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-[[1-(ethoxymethyl)cyclobutyl]methyl]-2-(2-oxopyrrolidin-1-yl)propanamide is sourced from PubChem (CID 125441691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).