[1-(4-methoxy-3-pyridinyl)-5-oxopyrrolidin-3-yl]methanesulfonamide

C11H15N3O4S — CID 168681206

IUPAC[1-(4-methoxy-3-pyridinyl)-5-oxopyrrolidin-3-yl]methanesulfonamide
SMILESCOc1ccncc1N1CC(CS(N)(=O)=O)CC1=O
InChIInChI=1S/C11H15N3O4S/c1-18-10-2-3-13-5-9(10)14-6-8(4-11(14)15)7-19(12,16)17/h2-3,5,8H,4,6-7H2,1H3,(H2,12,16,17)
InChIKeyGLHFVAFOVQVYJQ-UHFFFAOYSA-N
MW285.32 g/mol
LogP-0.27
Rot. Bonds4

About [1-(4-methoxy-3-pyridinyl)-5-oxopyrrolidin-3-yl]methanesulfonamide

[1-(4-methoxy-3-pyridinyl)-5-oxopyrrolidin-3-yl]methanesulfonamide (PubChem CID 168681206) has the molecular formula C11H15N3O4S and a molecular weight of 285.32 g/mol. Its IUPAC name is [1-(4-methoxy-3-pyridinyl)-5-oxopyrrolidin-3-yl]methanesulfonamide.

Molecular Properties

Compound Name[1-(4-methoxy-3-pyridinyl)-5-oxopyrrolidin-3-yl]methanesulfonamide
PubChem CID168681206
Molecular FormulaC11H15N3O4S
Molecular Weight285.32 g/mol
Exact Mass285.08
IUPAC Name[1-(4-methoxy-3-pyridinyl)-5-oxopyrrolidin-3-yl]methanesulfonamide
SMILESCOc1ccncc1N1CC(CS(N)(=O)=O)CC1=O
InChIInChI=1S/C11H15N3O4S/c1-18-10-2-3-13-5-9(10)14-6-8(4-11(14)15)7-19(12,16)17/h2-3,5,8H,4,6-7H2,1H3,(H2,12,16,17)
InChIKeyGLHFVAFOVQVYJQ-UHFFFAOYSA-N
XLogP-0.27
TPSA102.59 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.32
LogP ≤ 5-0.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-(4-methoxy-3-pyridinyl)-5-oxopyrrolidine-3-sulfonamide
CID 168717451
4-amino-1-(4-methoxy-3-pyridinyl)pyrrolidin-2-one
CID 168699582
1-(4-methoxy-3-pyridinyl)-5-oxopyrrolidine-3-sulfonyl chloride
CID 168711528
[1-(4-bromo-2-chloro-5-methoxyphenyl)-5-oxopyrrolidin-3-yl]methanesulfonamide
CID 168681124
(5-oxo-1-pyridazin-4-ylpyrrolidin-3-yl)methanesulfonamide
CID 168683247
[1-(4-amino-2-methylphenyl)-5-oxopyrrolidin-3-yl]methanesulfonamide
CID 168681397
[1-(6-chloro-2-methyl-3-pyridinyl)-5-oxopyrrolidin-3-yl]methanesulfonamide
CID 168681533
[1-(5-bromo-6-methoxy-3-pyridinyl)-5-oxopyrrolidin-3-yl]methanesulfonamide
CID 168681216
[1-[4-methoxy-3-(trifluoromethyl)phenyl]-5-oxopyrrolidin-3-yl]methanesulfonamide
CID 168681139
[1-(2-ethoxy-5-methylphenyl)-5-oxopyrrolidin-3-yl]methanesulfonamide
CID 168680870
[1-(8-methylquinolin-5-yl)-5-oxopyrrolidin-3-yl]methanesulfonamide
CID 168681419
[1-(2-cyano-5-methoxyphenyl)-5-oxopyrrolidin-3-yl]methanesulfonamide
CID 168681150

Frequently Asked Questions

What is the IUPAC name of [1-(4-methoxy-3-pyridinyl)-5-oxopyrrolidin-3-yl]methanesulfonamide?
The IUPAC name of [1-(4-methoxy-3-pyridinyl)-5-oxopyrrolidin-3-yl]methanesulfonamide (CID 168681206) is [1-(4-methoxy-3-pyridinyl)-5-oxopyrrolidin-3-yl]methanesulfonamide.
What is the SMILES notation for [1-(4-methoxy-3-pyridinyl)-5-oxopyrrolidin-3-yl]methanesulfonamide?
The canonical SMILES for [1-(4-methoxy-3-pyridinyl)-5-oxopyrrolidin-3-yl]methanesulfonamide is COc1ccncc1N1CC(CS(N)(=O)=O)CC1=O.
What is the InChIKey of [1-(4-methoxy-3-pyridinyl)-5-oxopyrrolidin-3-yl]methanesulfonamide?
The InChIKey is GLHFVAFOVQVYJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O4S/c1-18-10-2-3-13-5-9(10)14-6-8(4-11(14)15)7-19(12,16)17/h2-3,5,8H,4,6-7H2,1H3,(H2,12,16,17).
What are the key properties of [1-(4-methoxy-3-pyridinyl)-5-oxopyrrolidin-3-yl]methanesulfonamide?
[1-(4-methoxy-3-pyridinyl)-5-oxopyrrolidin-3-yl]methanesulfonamide has a molecular weight of 285.32 g/mol, XLogP of -0.27, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(4-methoxy-3-pyridinyl)-5-oxopyrrolidin-3-yl]methanesulfonamide is sourced from PubChem (CID 168681206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).