2-[(3-amino-2-pyridinyl)sulfonyl]-N-pentan-2-ylacetamide

C12H19N3O3S — CID 61489654

IUPAC2-[(3-amino-2-pyridinyl)sulfonyl]-N-pentan-2-ylacetamide
SMILESCCCC(C)NC(=O)CS(=O)(=O)c1ncccc1N
InChIInChI=1S/C12H19N3O3S/c1-3-5-9(2)15-11(16)8-19(17,18)12-10(13)6-4-7-14-12/h4,6-7,9H,3,5,8,13H2,1-2H3,(H,15,16)
InChIKeyPKPMPFFUBAPJDP-UHFFFAOYSA-N
MW285.37 g/mol
LogP0.74
Rot. Bonds6

About 2-[(3-amino-2-pyridinyl)sulfonyl]-N-pentan-2-ylacetamide

2-[(3-amino-2-pyridinyl)sulfonyl]-N-pentan-2-ylacetamide (PubChem CID 61489654) has the molecular formula C12H19N3O3S and a molecular weight of 285.37 g/mol. Its IUPAC name is 2-[(3-amino-2-pyridinyl)sulfonyl]-N-pentan-2-ylacetamide.

Molecular Properties

Compound Name2-[(3-amino-2-pyridinyl)sulfonyl]-N-pentan-2-ylacetamide
PubChem CID61489654
Molecular FormulaC12H19N3O3S
Molecular Weight285.37 g/mol
Exact Mass285.11
IUPAC Name2-[(3-amino-2-pyridinyl)sulfonyl]-N-pentan-2-ylacetamide
SMILESCCCC(C)NC(=O)CS(=O)(=O)c1ncccc1N
InChIInChI=1S/C12H19N3O3S/c1-3-5-9(2)15-11(16)8-19(17,18)12-10(13)6-4-7-14-12/h4,6-7,9H,3,5,8,13H2,1-2H3,(H,15,16)
InChIKeyPKPMPFFUBAPJDP-UHFFFAOYSA-N
XLogP0.74
TPSA102.15 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.37
LogP ≤ 50.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-[(3-amino-2-pyridinyl)sulfonyl]-N-(3-methylbutyl)acetamide
CID 61486701
2-(2-amino-6-chlorophenyl)sulfonyl-N-pentan-2-ylacetamide
CID 81185379
2-(2-amino-5-methylphenyl)sulfonyl-N-pentan-2-ylacetamide
CID 81183653
2-[(3-amino-2-pyridinyl)sulfonylamino]-N-propan-2-ylacetamide
CID 103304775
2-(4-amino-3-chlorophenyl)sulfonyl-N-pentan-2-ylacetamide
CID 81202581
3-amino-N-(4-methylpentan-2-yl)pyridine-2-sulfonamide
CID 103304535
2-[(3-amino-2-pyridinyl)sulfonyl]-N,N-diethylpropanamide
CID 61368040
2-isoquinolin-1-ylsulfonyl-N-propan-2-ylacetamide
CID 154766657
3-amino-N-propan-2-ylpyridine-2-sulfonamide
CID 103303655
2-[(3R)-3-methylpentan-2-yl]sulfonylpyridin-3-amine
CID 163546017
2-[(3-amino-2-pyridinyl)sulfonyl]-N-(ethylcarbamoyl)propanamide
CID 61367269
2-[(3-amino-2-pyridinyl)sulfanyl]-N-butan-2-ylacetamide
CID 43300815

Frequently Asked Questions

What is the IUPAC name of 2-[(3-amino-2-pyridinyl)sulfonyl]-N-pentan-2-ylacetamide?
The IUPAC name of 2-[(3-amino-2-pyridinyl)sulfonyl]-N-pentan-2-ylacetamide (CID 61489654) is 2-[(3-amino-2-pyridinyl)sulfonyl]-N-pentan-2-ylacetamide.
What is the SMILES notation for 2-[(3-amino-2-pyridinyl)sulfonyl]-N-pentan-2-ylacetamide?
The canonical SMILES for 2-[(3-amino-2-pyridinyl)sulfonyl]-N-pentan-2-ylacetamide is CCCC(C)NC(=O)CS(=O)(=O)c1ncccc1N.
What is the InChIKey of 2-[(3-amino-2-pyridinyl)sulfonyl]-N-pentan-2-ylacetamide?
The InChIKey is PKPMPFFUBAPJDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O3S/c1-3-5-9(2)15-11(16)8-19(17,18)12-10(13)6-4-7-14-12/h4,6-7,9H,3,5,8,13H2,1-2H3,(H,15,16).
What are the key properties of 2-[(3-amino-2-pyridinyl)sulfonyl]-N-pentan-2-ylacetamide?
2-[(3-amino-2-pyridinyl)sulfonyl]-N-pentan-2-ylacetamide has a molecular weight of 285.37 g/mol, XLogP of 0.74, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-amino-2-pyridinyl)sulfonyl]-N-pentan-2-ylacetamide is sourced from PubChem (CID 61489654), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).