2-[(5-pyrrolidin-1-ylsulfonyl-2-pyridinyl)amino]acetamide

C11H16N4O3S — CID 8567255

IUPAC2-[(5-pyrrolidin-1-ylsulfonyl-2-pyridinyl)amino]acetamide
SMILESNC(=O)CNc1ccc(S(=O)(=O)N2CCCC2)cn1
InChIInChI=1S/C11H16N4O3S/c12-10(16)8-14-11-4-3-9(7-13-11)19(17,18)15-5-1-2-6-15/h3-4,7H,1-2,5-6,8H2,(H2,12,16)(H,13,14)
InChIKeyNTWXPRHAERWWNF-UHFFFAOYSA-N
MW284.34 g/mol
LogP-0.24
Rot. Bonds5

About 2-[(5-pyrrolidin-1-ylsulfonyl-2-pyridinyl)amino]acetamide

2-[(5-pyrrolidin-1-ylsulfonyl-2-pyridinyl)amino]acetamide (PubChem CID 8567255) has the molecular formula C11H16N4O3S and a molecular weight of 284.34 g/mol. Its IUPAC name is 2-[(5-pyrrolidin-1-ylsulfonyl-2-pyridinyl)amino]acetamide.

Molecular Properties

Compound Name2-[(5-pyrrolidin-1-ylsulfonyl-2-pyridinyl)amino]acetamide
PubChem CID8567255
Molecular FormulaC11H16N4O3S
Molecular Weight284.34 g/mol
Exact Mass284.09
IUPAC Name2-[(5-pyrrolidin-1-ylsulfonyl-2-pyridinyl)amino]acetamide
SMILESNC(=O)CNc1ccc(S(=O)(=O)N2CCCC2)cn1
InChIInChI=1S/C11H16N4O3S/c12-10(16)8-14-11-4-3-9(7-13-11)19(17,18)15-5-1-2-6-15/h3-4,7H,1-2,5-6,8H2,(H2,12,16)(H,13,14)
InChIKeyNTWXPRHAERWWNF-UHFFFAOYSA-N
XLogP-0.24
TPSA105.39 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.34
LogP ≤ 5-0.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[(5-pyrrolidin-1-ylsulfonyl-2-pyridinyl)amino]acetamide?
The IUPAC name of 2-[(5-pyrrolidin-1-ylsulfonyl-2-pyridinyl)amino]acetamide (CID 8567255) is 2-[(5-pyrrolidin-1-ylsulfonyl-2-pyridinyl)amino]acetamide.
What is the SMILES notation for 2-[(5-pyrrolidin-1-ylsulfonyl-2-pyridinyl)amino]acetamide?
The canonical SMILES for 2-[(5-pyrrolidin-1-ylsulfonyl-2-pyridinyl)amino]acetamide is NC(=O)CNc1ccc(S(=O)(=O)N2CCCC2)cn1.
What is the InChIKey of 2-[(5-pyrrolidin-1-ylsulfonyl-2-pyridinyl)amino]acetamide?
The InChIKey is NTWXPRHAERWWNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4O3S/c12-10(16)8-14-11-4-3-9(7-13-11)19(17,18)15-5-1-2-6-15/h3-4,7H,1-2,5-6,8H2,(H2,12,16)(H,13,14).
What are the key properties of 2-[(5-pyrrolidin-1-ylsulfonyl-2-pyridinyl)amino]acetamide?
2-[(5-pyrrolidin-1-ylsulfonyl-2-pyridinyl)amino]acetamide has a molecular weight of 284.34 g/mol, XLogP of -0.24, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-pyrrolidin-1-ylsulfonyl-2-pyridinyl)amino]acetamide is sourced from PubChem (CID 8567255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).