2-(3-hydroxy-2-oxopyrrolidin-1-yl)butanamide

C8H14N2O3 — CID 54398539

IUPAC2-(3-hydroxy-2-oxopyrrolidin-1-yl)butanamide
SMILESCCC(C(N)=O)N1CCC(O)C1=O
InChIInChI=1S/C8H14N2O3/c1-2-5(7(9)12)10-4-3-6(11)8(10)13/h5-6,11H,2-4H2,1H3,(H2,9,12)
InChIKeyVLTAPAUSWRQGMN-UHFFFAOYSA-N
MW186.21 g/mol
LogP-1.16
Rot. Bonds3

About 2-(3-hydroxy-2-oxopyrrolidin-1-yl)butanamide

2-(3-hydroxy-2-oxopyrrolidin-1-yl)butanamide (PubChem CID 54398539) has the molecular formula C8H14N2O3 and a molecular weight of 186.21 g/mol. Its IUPAC name is 2-(3-hydroxy-2-oxopyrrolidin-1-yl)butanamide.

Molecular Properties

Compound Name2-(3-hydroxy-2-oxopyrrolidin-1-yl)butanamide
PubChem CID54398539
Molecular FormulaC8H14N2O3
Molecular Weight186.21 g/mol
Exact Mass186.10
IUPAC Name2-(3-hydroxy-2-oxopyrrolidin-1-yl)butanamide
SMILESCCC(C(N)=O)N1CCC(O)C1=O
InChIInChI=1S/C8H14N2O3/c1-2-5(7(9)12)10-4-3-6(11)8(10)13/h5-6,11H,2-4H2,1H3,(H2,9,12)
InChIKeyVLTAPAUSWRQGMN-UHFFFAOYSA-N
XLogP-1.16
TPSA83.63 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.21
LogP ≤ 5-1.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

Oxiracetam
CID 4626
(S)-Oxiracetam
CID 6603951
2-[(4R)-4-hydroxy-2-oxopyrrolidin-1-yl]acetamide
CID 3051965
(2S,3R)-2-amino-3-hydroxy-1-(pyrrolidin-1-yl)butan-1-one
CID 44560823
cis-(+-)-N-(2-(2,6-Dimethyl-1-piperidinyl)ethyl)-2-oxo-3-hydroxy-1-pyrrolidineacetamide
CID 3069833
1-Pyrrolidineacetamide, 3-hydroxy-2-oxo-, (S)-
CID 3069834
1-Pyrrolidineacetamide, 3-hydroxy-2-oxo-, (R)-
CID 3069835
1-Pyrrolidineacetamide, N-(2-(bis(1-methylethyl)amino)ethyl-3-hydroxy-2-oxo-, (+-)-
CID 3069836
1-Pyrrolidineacetamide, 3-hydroxy-2-oxo-, (+-)-
CID 3069854
2-(4-Hydroxy-2-oxopyrrolidin-1-yl)butanamide
CID 44367442
2-Amino-3-hydroxy-1-pyrrolidin-1-ylbutan-1-one
CID 21252067
3-Hydroxy-2-methylamino-1-pyrrolidin-1-yl-butan-1-one
CID 118719173

Frequently Asked Questions

What is the IUPAC name of 2-(3-hydroxy-2-oxopyrrolidin-1-yl)butanamide?
The IUPAC name of 2-(3-hydroxy-2-oxopyrrolidin-1-yl)butanamide (CID 54398539) is 2-(3-hydroxy-2-oxopyrrolidin-1-yl)butanamide.
What is the SMILES notation for 2-(3-hydroxy-2-oxopyrrolidin-1-yl)butanamide?
The canonical SMILES for 2-(3-hydroxy-2-oxopyrrolidin-1-yl)butanamide is CCC(C(N)=O)N1CCC(O)C1=O.
What is the InChIKey of 2-(3-hydroxy-2-oxopyrrolidin-1-yl)butanamide?
The InChIKey is VLTAPAUSWRQGMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2O3/c1-2-5(7(9)12)10-4-3-6(11)8(10)13/h5-6,11H,2-4H2,1H3,(H2,9,12).
What are the key properties of 2-(3-hydroxy-2-oxopyrrolidin-1-yl)butanamide?
2-(3-hydroxy-2-oxopyrrolidin-1-yl)butanamide has a molecular weight of 186.21 g/mol, XLogP of -1.16, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-hydroxy-2-oxopyrrolidin-1-yl)butanamide is sourced from PubChem (CID 54398539), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).