1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-4-hydroxypyrrolidin-2-one

C10H14N2O3 — CID 79237977

IUPAC1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-4-hydroxypyrrolidin-2-one
SMILESCc1noc(C)c1CN1CC(O)CC1=O
InChIInChI=1S/C10H14N2O3/c1-6-9(7(2)15-11-6)5-12-4-8(13)3-10(12)14/h8,13H,3-5H2,1-2H3
InChIKeyGUPQQKCUMQPMPS-UHFFFAOYSA-N
MW210.23 g/mol
LogP0.38
Rot. Bonds2

About 1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-4-hydroxypyrrolidin-2-one

1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-4-hydroxypyrrolidin-2-one (PubChem CID 79237977) has the molecular formula C10H14N2O3 and a molecular weight of 210.23 g/mol. Its IUPAC name is 1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-4-hydroxypyrrolidin-2-one.

Molecular Properties

Compound Name1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-4-hydroxypyrrolidin-2-one
PubChem CID79237977
Molecular FormulaC10H14N2O3
Molecular Weight210.23 g/mol
Exact Mass210.10
IUPAC Name1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-4-hydroxypyrrolidin-2-one
SMILESCc1noc(C)c1CN1CC(O)CC1=O
InChIInChI=1S/C10H14N2O3/c1-6-9(7(2)15-11-6)5-12-4-8(13)3-10(12)14/h8,13H,3-5H2,1-2H3
InChIKeyGUPQQKCUMQPMPS-UHFFFAOYSA-N
XLogP0.38
TPSA66.57 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.23
LogP ≤ 50.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-4-hydroxypyrrolidin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-4-hydroxypyrrolidin-2-one?
The IUPAC name of 1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-4-hydroxypyrrolidin-2-one (CID 79237977) is 1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-4-hydroxypyrrolidin-2-one.
What is the SMILES notation for 1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-4-hydroxypyrrolidin-2-one?
The canonical SMILES for 1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-4-hydroxypyrrolidin-2-one is Cc1noc(C)c1CN1CC(O)CC1=O.
What is the InChIKey of 1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-4-hydroxypyrrolidin-2-one?
The InChIKey is GUPQQKCUMQPMPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O3/c1-6-9(7(2)15-11-6)5-12-4-8(13)3-10(12)14/h8,13H,3-5H2,1-2H3.
What are the key properties of 1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-4-hydroxypyrrolidin-2-one?
1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-4-hydroxypyrrolidin-2-one has a molecular weight of 210.23 g/mol, XLogP of 0.38, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-4-hydroxypyrrolidin-2-one is sourced from PubChem (CID 79237977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).