N-[2-[3-[(2,4-dioxo-1,3-oxazolidin-3-yl)methyl]azetidin-1-yl]-2-oxoethyl]-N-methylmethanesulfonamide

C11H17N3O6S — CID 122275004

IUPACN-[2-[3-[(2,4-dioxo-1,3-oxazolidin-3-yl)methyl]azetidin-1-yl]-2-oxoethyl]-N-methylmethanesulfonamide
SMILESCN(CC(=O)N1CC(CN2C(=O)COC2=O)C1)S(C)(=O)=O
InChIInChI=1S/C11H17N3O6S/c1-12(21(2,18)19)6-9(15)13-3-8(4-13)5-14-10(16)7-20-11(14)17/h8H,3-7H2,1-2H3
InChIKeyQGZUPPOJSDKWFI-UHFFFAOYSA-N
MW319.34 g/mol
LogP-1.68
Rot. Bonds5

About N-[2-[3-[(2,4-dioxo-1,3-oxazolidin-3-yl)methyl]azetidin-1-yl]-2-oxoethyl]-N-methylmethanesulfonamide

N-[2-[3-[(2,4-dioxo-1,3-oxazolidin-3-yl)methyl]azetidin-1-yl]-2-oxoethyl]-N-methylmethanesulfonamide (PubChem CID 122275004) has the molecular formula C11H17N3O6S and a molecular weight of 319.34 g/mol. Its IUPAC name is N-[2-[3-[(2,4-dioxo-1,3-oxazolidin-3-yl)methyl]azetidin-1-yl]-2-oxoethyl]-N-methylmethanesulfonamide.

Molecular Properties

Compound NameN-[2-[3-[(2,4-dioxo-1,3-oxazolidin-3-yl)methyl]azetidin-1-yl]-2-oxoethyl]-N-methylmethanesulfonamide
PubChem CID122275004
Molecular FormulaC11H17N3O6S
Molecular Weight319.34 g/mol
Exact Mass319.08
IUPAC NameN-[2-[3-[(2,4-dioxo-1,3-oxazolidin-3-yl)methyl]azetidin-1-yl]-2-oxoethyl]-N-methylmethanesulfonamide
SMILESCN(CC(=O)N1CC(CN2C(=O)COC2=O)C1)S(C)(=O)=O
InChIInChI=1S/C11H17N3O6S/c1-12(21(2,18)19)6-9(15)13-3-8(4-13)5-14-10(16)7-20-11(14)17/h8H,3-7H2,1-2H3
InChIKeyQGZUPPOJSDKWFI-UHFFFAOYSA-N
XLogP-1.68
TPSA104.30 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.34
LogP ≤ 5-1.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

4-[3-[(2,4-dioxo-1,3-oxazolidin-3-yl)methyl]azetidine-1-carbonyl]-N,N-dimethylbenzenesulfonamide
CID 122274818
3-[[1-[2-(4-bromophenyl)acetyl]azetidin-3-yl]methyl]-1,3-oxazolidine-2,4-dione
CID 119105359
3-[[1-[3-(3-methylthiophen-2-yl)propanoyl]azetidin-3-yl]methyl]-1,3-oxazolidine-2,4-dione
CID 122274844
3-[[1-(4-bromobenzoyl)azetidin-3-yl]methyl]-1,3-oxazolidine-2,4-dione
CID 121022578
N-[2-[3-[(2,4-dioxo-1,3-oxazolidin-3-yl)methyl]azetidin-1-yl]-2-oxoethyl]benzamide
CID 122274905
cyclobutylmethyl 3-[(2,4-dioxo-1,3-oxazolidin-3-yl)methyl]azetidine-1-carboxylate
CID 122275018
N-[2-[3-(2-hydroxypropan-2-yl)azetidin-1-yl]-2-oxoethyl]-N-methylmethanesulfonamide
CID 136534158
3-[[1-[3-(4-fluoro-3-methylphenyl)propanoyl]azetidin-3-yl]methyl]-1,3-oxazolidine-2,4-dione
CID 122274849
3-[[1-[2-(2-oxo-1,3-benzoxazol-3-yl)acetyl]azetidin-3-yl]methyl]-1,3-oxazolidine-2,4-dione
CID 122274806
3-[[1-(3-methylbenzoyl)azetidin-3-yl]methyl]-1,3-oxazolidine-2,4-dione
CID 122274940
3-[[1-[3-(4-chlorophenyl)prop-2-enoyl]azetidin-3-yl]methyl]-1,3-oxazolidine-2,4-dione
CID 171137356
3-[[1-(4-propan-2-yloxybenzoyl)azetidin-3-yl]methyl]-1,3-oxazolidine-2,4-dione
CID 122274788

Frequently Asked Questions

What is the IUPAC name of N-[2-[3-[(2,4-dioxo-1,3-oxazolidin-3-yl)methyl]azetidin-1-yl]-2-oxoethyl]-N-methylmethanesulfonamide?
The IUPAC name of N-[2-[3-[(2,4-dioxo-1,3-oxazolidin-3-yl)methyl]azetidin-1-yl]-2-oxoethyl]-N-methylmethanesulfonamide (CID 122275004) is N-[2-[3-[(2,4-dioxo-1,3-oxazolidin-3-yl)methyl]azetidin-1-yl]-2-oxoethyl]-N-methylmethanesulfonamide.
What is the SMILES notation for N-[2-[3-[(2,4-dioxo-1,3-oxazolidin-3-yl)methyl]azetidin-1-yl]-2-oxoethyl]-N-methylmethanesulfonamide?
The canonical SMILES for N-[2-[3-[(2,4-dioxo-1,3-oxazolidin-3-yl)methyl]azetidin-1-yl]-2-oxoethyl]-N-methylmethanesulfonamide is CN(CC(=O)N1CC(CN2C(=O)COC2=O)C1)S(C)(=O)=O.
What is the InChIKey of N-[2-[3-[(2,4-dioxo-1,3-oxazolidin-3-yl)methyl]azetidin-1-yl]-2-oxoethyl]-N-methylmethanesulfonamide?
The InChIKey is QGZUPPOJSDKWFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O6S/c1-12(21(2,18)19)6-9(15)13-3-8(4-13)5-14-10(16)7-20-11(14)17/h8H,3-7H2,1-2H3.
What are the key properties of N-[2-[3-[(2,4-dioxo-1,3-oxazolidin-3-yl)methyl]azetidin-1-yl]-2-oxoethyl]-N-methylmethanesulfonamide?
N-[2-[3-[(2,4-dioxo-1,3-oxazolidin-3-yl)methyl]azetidin-1-yl]-2-oxoethyl]-N-methylmethanesulfonamide has a molecular weight of 319.34 g/mol, XLogP of -1.68, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[3-[(2,4-dioxo-1,3-oxazolidin-3-yl)methyl]azetidin-1-yl]-2-oxoethyl]-N-methylmethanesulfonamide is sourced from PubChem (CID 122275004), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).