(3,5-dimethyl-1,2-oxazol-4-yl)-[(3R)-3-hydroxypyrrolidin-1-yl]methanone

C10H14N2O3 — CID 66260663

IUPAC(3,5-dimethyl-1,2-oxazol-4-yl)-[(3R)-3-hydroxypyrrolidin-1-yl]methanone
SMILESCc1noc(C)c1C(=O)N1CC[C@@H](O)C1
InChIInChI=1S/C10H14N2O3/c1-6-9(7(2)15-11-6)10(14)12-4-3-8(13)5-12/h8,13H,3-5H2,1-2H3/t8-/m1/s1
InChIKeyDMBPYDUNXLEHJE-MRVPVSSYSA-N
MW210.23 g/mol
LogP0.50
Rot. Bonds1

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

(3,5-dimethyl-1,2-oxazol-4-yl)-[(3R)-3-hydroxypyrrolidin-1-yl]methanone (PubChem CID 66260663) has the molecular formula C10H14N2O3 and a molecular weight of 210.23 g/mol. Its IUPAC name is (3,5-dimethyl-1,2-oxazol-4-yl)-[(3R)-3-hydroxypyrrolidin-1-yl]methanone.

Molecular Properties

Compound Name(3,5-dimethyl-1,2-oxazol-4-yl)-[(3R)-3-hydroxypyrrolidin-1-yl]methanone
PubChem CID66260663
Molecular FormulaC10H14N2O3
Molecular Weight210.23 g/mol
Exact Mass210.10
IUPAC Name(3,5-dimethyl-1,2-oxazol-4-yl)-[(3R)-3-hydroxypyrrolidin-1-yl]methanone
SMILESCc1noc(C)c1C(=O)N1CC[C@@H](O)C1
InChIInChI=1S/C10H14N2O3/c1-6-9(7(2)15-11-6)10(14)12-4-3-8(13)5-12/h8,13H,3-5H2,1-2H3/t8-/m1/s1
InChIKeyDMBPYDUNXLEHJE-MRVPVSSYSA-N
XLogP0.50
TPSA66.57 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.23
LogP ≤ 50.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (3,5-dimethyl-1,2-oxazol-4-yl)-[(3R)-3-hydroxypyrrolidin-1-yl]methanone?
The IUPAC name of (3,5-dimethyl-1,2-oxazol-4-yl)-[(3R)-3-hydroxypyrrolidin-1-yl]methanone (CID 66260663) is (3,5-dimethyl-1,2-oxazol-4-yl)-[(3R)-3-hydroxypyrrolidin-1-yl]methanone.
What is the SMILES notation for (3,5-dimethyl-1,2-oxazol-4-yl)-[(3R)-3-hydroxypyrrolidin-1-yl]methanone?
The canonical SMILES for (3,5-dimethyl-1,2-oxazol-4-yl)-[(3R)-3-hydroxypyrrolidin-1-yl]methanone is Cc1noc(C)c1C(=O)N1CC[C@@H](O)C1.
What is the InChIKey of (3,5-dimethyl-1,2-oxazol-4-yl)-[(3R)-3-hydroxypyrrolidin-1-yl]methanone?
The InChIKey is DMBPYDUNXLEHJE-MRVPVSSYSA-N. The full InChI is InChI=1S/C10H14N2O3/c1-6-9(7(2)15-11-6)10(14)12-4-3-8(13)5-12/h8,13H,3-5H2,1-2H3/t8-/m1/s1.
What are the key properties of (3,5-dimethyl-1,2-oxazol-4-yl)-[(3R)-3-hydroxypyrrolidin-1-yl]methanone?
(3,5-dimethyl-1,2-oxazol-4-yl)-[(3R)-3-hydroxypyrrolidin-1-yl]methanone has a molecular weight of 210.23 g/mol, XLogP of 0.50, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3,5-dimethyl-1,2-oxazol-4-yl)-[(3R)-3-hydroxypyrrolidin-1-yl]methanone is sourced from PubChem (CID 66260663), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).