(5R)-1-hydroxy-5-methylpyrrolidin-2-one

C5H9NO2 — CID 56612622

IUPAC(5R)-1-hydroxy-5-methylpyrrolidin-2-one
SMILESC[C@@H]1CCC(=O)N1O
InChIInChI=1S/C5H9NO2/c1-4-2-3-5(7)6(4)8/h4,8H,2-3H2,1H3/t4-/m1/s1
InChIKeyMPHXVCJDZHKHDC-SCSAIBSYSA-N
MW115.13 g/mol
LogP0.39
Rot. Bonds

About (5R)-1-hydroxy-5-methylpyrrolidin-2-one

(5R)-1-hydroxy-5-methylpyrrolidin-2-one (PubChem CID 56612622) has the molecular formula C5H9NO2 and a molecular weight of 115.13 g/mol. Its IUPAC name is (5R)-1-hydroxy-5-methylpyrrolidin-2-one.

Molecular Properties

Compound Name(5R)-1-hydroxy-5-methylpyrrolidin-2-one
PubChem CID56612622
Molecular FormulaC5H9NO2
Molecular Weight115.13 g/mol
Exact Mass115.06
IUPAC Name(5R)-1-hydroxy-5-methylpyrrolidin-2-one
SMILESC[C@@H]1CCC(=O)N1O
InChIInChI=1S/C5H9NO2/c1-4-2-3-5(7)6(4)8/h4,8H,2-3H2,1H3/t4-/m1/s1
InChIKeyMPHXVCJDZHKHDC-SCSAIBSYSA-N
XLogP0.39
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500115.13
LogP ≤ 50.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}

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Related Compounds

(5R)-5-methyl-1-(methylamino)pyrrolidin-2-one
CID 148786842
(5S)-5-methyl-1-propan-2-ylpyrrolidin-2-one
CID 152785079
(5R)-1-ethyl-5-methylpyrrolidin-2-one
CID 122427829
1,5-dimethylpyrrolidin-2-one;nitric acid
CID 69230280
1-hydroxy-5,5,6-trimethylpiperidin-2-one
CID 102314658
ethene;(5R)-5-methyl-1-propylpyrrolidin-2-one
CID 145214159
2-(2-methyl-5-oxopyrrolidin-1-yl)butanamide
CID 72770362
5-methyl-1-(2-nitrosoethyl)pyrrolidin-2-one
CID 137397074
(2R)-2-(2-cyanopropan-2-yl)-5-oxopyrrolidine-1-carboxylic acid
CID 138487812
6-methyl-1-azabicyclo[3.1.0]hexan-2-one
CID 143719689
3-hydroxy-1-methoxypiperidine-2,6-dione
CID 167136496
CID 89146118
CID 89146118

Frequently Asked Questions

What is the IUPAC name of (5R)-1-hydroxy-5-methylpyrrolidin-2-one?
The IUPAC name of (5R)-1-hydroxy-5-methylpyrrolidin-2-one (CID 56612622) is (5R)-1-hydroxy-5-methylpyrrolidin-2-one.
What is the SMILES notation for (5R)-1-hydroxy-5-methylpyrrolidin-2-one?
The canonical SMILES for (5R)-1-hydroxy-5-methylpyrrolidin-2-one is C[C@@H]1CCC(=O)N1O.
What is the InChIKey of (5R)-1-hydroxy-5-methylpyrrolidin-2-one?
The InChIKey is MPHXVCJDZHKHDC-SCSAIBSYSA-N. The full InChI is InChI=1S/C5H9NO2/c1-4-2-3-5(7)6(4)8/h4,8H,2-3H2,1H3/t4-/m1/s1.
What are the key properties of (5R)-1-hydroxy-5-methylpyrrolidin-2-one?
(5R)-1-hydroxy-5-methylpyrrolidin-2-one has a molecular weight of 115.13 g/mol, XLogP of 0.39, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-1-hydroxy-5-methylpyrrolidin-2-one is sourced from PubChem (CID 56612622), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).