N-methyl-2-[methyl(pyrrolidin-3-ylsulfonyl)amino]acetamide

C8H17N3O3S — CID 65420708

IUPACN-methyl-2-[methyl(pyrrolidin-3-ylsulfonyl)amino]acetamide
SMILESCNC(=O)CN(C)S(=O)(=O)C1CCNC1
InChIInChI=1S/C8H17N3O3S/c1-9-8(12)6-11(2)15(13,14)7-3-4-10-5-7/h7,10H,3-6H2,1-2H3,(H,9,12)
InChIKeyILZCSJACGXSXJF-UHFFFAOYSA-N
MW235.31 g/mol
LogP-1.64
Rot. Bonds4

About N-methyl-2-[methyl(pyrrolidin-3-ylsulfonyl)amino]acetamide

N-methyl-2-[methyl(pyrrolidin-3-ylsulfonyl)amino]acetamide (PubChem CID 65420708) has the molecular formula C8H17N3O3S and a molecular weight of 235.31 g/mol. Its IUPAC name is N-methyl-2-[methyl(pyrrolidin-3-ylsulfonyl)amino]acetamide.

Molecular Properties

Compound NameN-methyl-2-[methyl(pyrrolidin-3-ylsulfonyl)amino]acetamide
PubChem CID65420708
Molecular FormulaC8H17N3O3S
Molecular Weight235.31 g/mol
Exact Mass235.10
IUPAC NameN-methyl-2-[methyl(pyrrolidin-3-ylsulfonyl)amino]acetamide
SMILESCNC(=O)CN(C)S(=O)(=O)C1CCNC1
InChIInChI=1S/C8H17N3O3S/c1-9-8(12)6-11(2)15(13,14)7-3-4-10-5-7/h7,10H,3-6H2,1-2H3,(H,9,12)
InChIKeyILZCSJACGXSXJF-UHFFFAOYSA-N
XLogP-1.64
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.31
LogP ≤ 5-1.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-methyl-2-[methyl(pyrrolidin-3-ylsulfonyl)amino]acetamide?
The IUPAC name of N-methyl-2-[methyl(pyrrolidin-3-ylsulfonyl)amino]acetamide (CID 65420708) is N-methyl-2-[methyl(pyrrolidin-3-ylsulfonyl)amino]acetamide.
What is the SMILES notation for N-methyl-2-[methyl(pyrrolidin-3-ylsulfonyl)amino]acetamide?
The canonical SMILES for N-methyl-2-[methyl(pyrrolidin-3-ylsulfonyl)amino]acetamide is CNC(=O)CN(C)S(=O)(=O)C1CCNC1.
What is the InChIKey of N-methyl-2-[methyl(pyrrolidin-3-ylsulfonyl)amino]acetamide?
The InChIKey is ILZCSJACGXSXJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17N3O3S/c1-9-8(12)6-11(2)15(13,14)7-3-4-10-5-7/h7,10H,3-6H2,1-2H3,(H,9,12).
What are the key properties of N-methyl-2-[methyl(pyrrolidin-3-ylsulfonyl)amino]acetamide?
N-methyl-2-[methyl(pyrrolidin-3-ylsulfonyl)amino]acetamide has a molecular weight of 235.31 g/mol, XLogP of -1.64, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-[methyl(pyrrolidin-3-ylsulfonyl)amino]acetamide is sourced from PubChem (CID 65420708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).