5,5-dimethyl-3-[2-[(2R)-2-(3-methyl-1,2-oxazol-5-yl)pyrrolidin-1-yl]-2-oxoethyl]-1,3-oxazolidine-2,4-dione

C15H19N3O5 — CID 97271109

IUPAC5,5-dimethyl-3-[2-[(2R)-2-(3-methyl-1,2-oxazol-5-yl)pyrrolidin-1-yl]-2-oxoethyl]-1,3-oxazolidine-2,4-dione
SMILESCc1cc([C@H]2CCCN2C(=O)CN2C(=O)OC(C)(C)C2=O)on1
InChIInChI=1S/C15H19N3O5/c1-9-7-11(23-16-9)10-5-4-6-17(10)12(19)8-18-13(20)15(2,3)22-14(18)21/h7,10H,4-6,8H2,1-3H3/t10-/m1/s1
InChIKeyPJIOUFQWDWKKHP-SNVBAGLBSA-N
MW321.33 g/mol
LogP1.40
Rot. Bonds3

About 5,5-dimethyl-3-[2-[(2R)-2-(3-methyl-1,2-oxazol-5-yl)pyrrolidin-1-yl]-2-oxoethyl]-1,3-oxazolidine-2,4-dione

5,5-dimethyl-3-[2-[(2R)-2-(3-methyl-1,2-oxazol-5-yl)pyrrolidin-1-yl]-2-oxoethyl]-1,3-oxazolidine-2,4-dione (PubChem CID 97271109) has the molecular formula C15H19N3O5 and a molecular weight of 321.33 g/mol. Its IUPAC name is 5,5-dimethyl-3-[2-[(2R)-2-(3-methyl-1,2-oxazol-5-yl)pyrrolidin-1-yl]-2-oxoethyl]-1,3-oxazolidine-2,4-dione.

Molecular Properties

Compound Name5,5-dimethyl-3-[2-[(2R)-2-(3-methyl-1,2-oxazol-5-yl)pyrrolidin-1-yl]-2-oxoethyl]-1,3-oxazolidine-2,4-dione
PubChem CID97271109
Molecular FormulaC15H19N3O5
Molecular Weight321.33 g/mol
Exact Mass321.13
IUPAC Name5,5-dimethyl-3-[2-[(2R)-2-(3-methyl-1,2-oxazol-5-yl)pyrrolidin-1-yl]-2-oxoethyl]-1,3-oxazolidine-2,4-dione
SMILESCc1cc([C@H]2CCCN2C(=O)CN2C(=O)OC(C)(C)C2=O)on1
InChIInChI=1S/C15H19N3O5/c1-9-7-11(23-16-9)10-5-4-6-17(10)12(19)8-18-13(20)15(2,3)22-14(18)21/h7,10H,4-6,8H2,1-3H3/t10-/m1/s1
InChIKeyPJIOUFQWDWKKHP-SNVBAGLBSA-N
XLogP1.40
TPSA92.95 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.33
LogP ≤ 51.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 5,5-dimethyl-3-[2-[(2R)-2-(3-methyl-1,2-oxazol-5-yl)pyrrolidin-1-yl]-2-oxoethyl]-1,3-oxazolidine-2,4-dione with MolForge

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Launch Full Analysis

Related Compounds

2-cyclopentyl-1-[2-(3-methyl-1,2-oxazol-5-yl)pyrrolidin-1-yl]ethanone
CID 53017109
2-(methylamino)-1-[2-(3-methyl-1,2-oxazol-5-yl)pyrrolidin-1-yl]ethanone
CID 60963154
3-[2-[2-(3-methyl-1,2-oxazol-5-yl)pyrrolidin-1-yl]-2-oxoethyl]-1-oxa-3,8-diazaspiro[4.5]decan-2-one
CID 72844562
3-[2-[2-(3-methyl-1,2-oxazol-5-yl)pyrrolidin-1-yl]-2-oxoethyl]-1-oxa-3,8-diazaspiro[4.5]decan-2-one;hydrochloride
CID 154899697
ethyl 4-[2-(3-methyl-1,2-oxazol-5-yl)pyrrolidin-1-yl]-4-oxobutanoate
CID 60976035
2-(cyclopropylmethylamino)-1-[2-(3-methyl-1,2-oxazol-5-yl)pyrrolidin-1-yl]ethanone
CID 54873423
2-(cyclopentylamino)-1-[2-(3-methyl-1,2-oxazol-5-yl)pyrrolidin-1-yl]ethanone
CID 60963976
7-amino-1-[2-(3-methyl-1,2-oxazol-5-yl)pyrrolidin-1-yl]heptan-1-one
CID 60962901
6-amino-1-[2-(3-methyl-1,2-oxazol-5-yl)pyrrolidin-1-yl]hexan-1-one
CID 54873356
2-(3-aminopyrazol-1-yl)-1-[2-(3-methyl-1,2-oxazol-5-yl)pyrrolidin-1-yl]ethanone
CID 62113566
cyclohexyl-[2-(3-methyl-1,2-oxazol-5-yl)pyrrolidin-1-yl]methanone
CID 53017114
5,5-dimethyl-3-[2-oxo-2-(2-phenylazetidin-1-yl)ethyl]-1,3-oxazolidine-2,4-dione
CID 72933399

Frequently Asked Questions

What is the IUPAC name of 5,5-dimethyl-3-[2-[(2R)-2-(3-methyl-1,2-oxazol-5-yl)pyrrolidin-1-yl]-2-oxoethyl]-1,3-oxazolidine-2,4-dione?
The IUPAC name of 5,5-dimethyl-3-[2-[(2R)-2-(3-methyl-1,2-oxazol-5-yl)pyrrolidin-1-yl]-2-oxoethyl]-1,3-oxazolidine-2,4-dione (CID 97271109) is 5,5-dimethyl-3-[2-[(2R)-2-(3-methyl-1,2-oxazol-5-yl)pyrrolidin-1-yl]-2-oxoethyl]-1,3-oxazolidine-2,4-dione.
What is the SMILES notation for 5,5-dimethyl-3-[2-[(2R)-2-(3-methyl-1,2-oxazol-5-yl)pyrrolidin-1-yl]-2-oxoethyl]-1,3-oxazolidine-2,4-dione?
The canonical SMILES for 5,5-dimethyl-3-[2-[(2R)-2-(3-methyl-1,2-oxazol-5-yl)pyrrolidin-1-yl]-2-oxoethyl]-1,3-oxazolidine-2,4-dione is Cc1cc([C@H]2CCCN2C(=O)CN2C(=O)OC(C)(C)C2=O)on1.
What is the InChIKey of 5,5-dimethyl-3-[2-[(2R)-2-(3-methyl-1,2-oxazol-5-yl)pyrrolidin-1-yl]-2-oxoethyl]-1,3-oxazolidine-2,4-dione?
The InChIKey is PJIOUFQWDWKKHP-SNVBAGLBSA-N. The full InChI is InChI=1S/C15H19N3O5/c1-9-7-11(23-16-9)10-5-4-6-17(10)12(19)8-18-13(20)15(2,3)22-14(18)21/h7,10H,4-6,8H2,1-3H3/t10-/m1/s1.
What are the key properties of 5,5-dimethyl-3-[2-[(2R)-2-(3-methyl-1,2-oxazol-5-yl)pyrrolidin-1-yl]-2-oxoethyl]-1,3-oxazolidine-2,4-dione?
5,5-dimethyl-3-[2-[(2R)-2-(3-methyl-1,2-oxazol-5-yl)pyrrolidin-1-yl]-2-oxoethyl]-1,3-oxazolidine-2,4-dione has a molecular weight of 321.33 g/mol, XLogP of 1.40, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5,5-dimethyl-3-[2-[(2R)-2-(3-methyl-1,2-oxazol-5-yl)pyrrolidin-1-yl]-2-oxoethyl]-1,3-oxazolidine-2,4-dione is sourced from PubChem (CID 97271109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).