(2S)-2-(2-oxopyrrolidin-1-yl)propanamide

C7H12N2O2 — CID 11423716

IUPAC(2S)-2-(2-oxopyrrolidin-1-yl)propanamide
SMILESC[C@@H](C(N)=O)N1CCCC1=O
InChIInChI=1S/C7H12N2O2/c1-5(7(8)11)9-4-2-3-6(9)10/h5H,2-4H2,1H3,(H2,8,11)/t5-/m0/s1
InChIKeyPVCADEDMUKXFIL-YFKPBYRVSA-N
MW156.19 g/mol
LogP-0.52
Rot. Bonds2

About (2S)-2-(2-oxopyrrolidin-1-yl)propanamide

(2S)-2-(2-oxopyrrolidin-1-yl)propanamide (PubChem CID 11423716) has the molecular formula C7H12N2O2 and a molecular weight of 156.19 g/mol. Its IUPAC name is (2S)-2-(2-oxopyrrolidin-1-yl)propanamide.

Molecular Properties

Compound Name(2S)-2-(2-oxopyrrolidin-1-yl)propanamide
PubChem CID11423716
Molecular FormulaC7H12N2O2
Molecular Weight156.19 g/mol
Exact Mass156.09
IUPAC Name(2S)-2-(2-oxopyrrolidin-1-yl)propanamide
SMILESC[C@@H](C(N)=O)N1CCCC1=O
InChIInChI=1S/C7H12N2O2/c1-5(7(8)11)9-4-2-3-6(9)10/h5H,2-4H2,1H3,(H2,8,11)/t5-/m0/s1
InChIKeyPVCADEDMUKXFIL-YFKPBYRVSA-N
XLogP-0.52
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.19
LogP ≤ 5-0.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2S)-2-(2-oxopyrrolidin-1-yl)propanamide?
The IUPAC name of (2S)-2-(2-oxopyrrolidin-1-yl)propanamide (CID 11423716) is (2S)-2-(2-oxopyrrolidin-1-yl)propanamide.
What is the SMILES notation for (2S)-2-(2-oxopyrrolidin-1-yl)propanamide?
The canonical SMILES for (2S)-2-(2-oxopyrrolidin-1-yl)propanamide is C[C@@H](C(N)=O)N1CCCC1=O.
What is the InChIKey of (2S)-2-(2-oxopyrrolidin-1-yl)propanamide?
The InChIKey is PVCADEDMUKXFIL-YFKPBYRVSA-N. The full InChI is InChI=1S/C7H12N2O2/c1-5(7(8)11)9-4-2-3-6(9)10/h5H,2-4H2,1H3,(H2,8,11)/t5-/m0/s1.
What are the key properties of (2S)-2-(2-oxopyrrolidin-1-yl)propanamide?
(2S)-2-(2-oxopyrrolidin-1-yl)propanamide has a molecular weight of 156.19 g/mol, XLogP of -0.52, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-(2-oxopyrrolidin-1-yl)propanamide is sourced from PubChem (CID 11423716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).