3-[(2-cyano-3-pyridinyl)sulfonylamino]-N-ethylpropanamide

C11H14N4O3S — CID 106596234

IUPAC3-[(2-cyano-3-pyridinyl)sulfonylamino]-N-ethylpropanamide
SMILESCCNC(=O)CCNS(=O)(=O)c1cccnc1C#N
InChIInChI=1S/C11H14N4O3S/c1-2-13-11(16)5-7-15-19(17,18)10-4-3-6-14-9(10)8-12/h3-4,6,15H,2,5,7H2,1H3,(H,13,16)
InChIKeySLJSFWHKBZNZSV-UHFFFAOYSA-N
MW282.32 g/mol
LogP-0.24
Rot. Bonds6

About 3-[(2-cyano-3-pyridinyl)sulfonylamino]-N-ethylpropanamide

3-[(2-cyano-3-pyridinyl)sulfonylamino]-N-ethylpropanamide (PubChem CID 106596234) has the molecular formula C11H14N4O3S and a molecular weight of 282.32 g/mol. Its IUPAC name is 3-[(2-cyano-3-pyridinyl)sulfonylamino]-N-ethylpropanamide.

Molecular Properties

Compound Name3-[(2-cyano-3-pyridinyl)sulfonylamino]-N-ethylpropanamide
PubChem CID106596234
Molecular FormulaC11H14N4O3S
Molecular Weight282.32 g/mol
Exact Mass282.08
IUPAC Name3-[(2-cyano-3-pyridinyl)sulfonylamino]-N-ethylpropanamide
SMILESCCNC(=O)CCNS(=O)(=O)c1cccnc1C#N
InChIInChI=1S/C11H14N4O3S/c1-2-13-11(16)5-7-15-19(17,18)10-4-3-6-14-9(10)8-12/h3-4,6,15H,2,5,7H2,1H3,(H,13,16)
InChIKeySLJSFWHKBZNZSV-UHFFFAOYSA-N
XLogP-0.24
TPSA111.95 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.32
LogP ≤ 5-0.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

methyl 6-[(2-cyano-3-pyridinyl)sulfonylamino]hexanoate
CID 106545225
2-cyano-N-(2-ethylsulfinylethyl)pyridine-3-sulfonamide
CID 106546033
2-cyano-N-(3-ethylsulfanylpropyl)pyridine-3-sulfonamide
CID 114248056
3-[(2-cyano-3-pyridinyl)sulfonylamino]-2,2-dimethylpropanoic acid
CID 106593434
2-cyano-N-[(2S)-2-hydroxypropyl]pyridine-3-sulfonamide
CID 106546656
2-cyano-N-pent-4-ynylpyridine-3-sulfonamide
CID 106546358
N-[2-(4-aminopyrazol-1-yl)ethyl]-2-cyanopyridine-3-sulfonamide
CID 106593209
2-cyano-N-(2,2,3-trimethylbutyl)pyridine-3-sulfonamide
CID 106546835
2-cyano-N-[2-(trifluoromethylsulfanyl)ethyl]pyridine-3-sulfonamide
CID 106545557
N-[2-(4-aminophenyl)ethyl]-2-cyanopyridine-3-sulfonamide
CID 106593181
2-cyano-N-ethoxypyridine-3-sulfonamide
CID 106593512
(2S)-2-[(2-cyano-3-pyridinyl)sulfonylamino]hexanoic acid
CID 107144955

Frequently Asked Questions

What is the IUPAC name of 3-[(2-cyano-3-pyridinyl)sulfonylamino]-N-ethylpropanamide?
The IUPAC name of 3-[(2-cyano-3-pyridinyl)sulfonylamino]-N-ethylpropanamide (CID 106596234) is 3-[(2-cyano-3-pyridinyl)sulfonylamino]-N-ethylpropanamide.
What is the SMILES notation for 3-[(2-cyano-3-pyridinyl)sulfonylamino]-N-ethylpropanamide?
The canonical SMILES for 3-[(2-cyano-3-pyridinyl)sulfonylamino]-N-ethylpropanamide is CCNC(=O)CCNS(=O)(=O)c1cccnc1C#N.
What is the InChIKey of 3-[(2-cyano-3-pyridinyl)sulfonylamino]-N-ethylpropanamide?
The InChIKey is SLJSFWHKBZNZSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N4O3S/c1-2-13-11(16)5-7-15-19(17,18)10-4-3-6-14-9(10)8-12/h3-4,6,15H,2,5,7H2,1H3,(H,13,16).
What are the key properties of 3-[(2-cyano-3-pyridinyl)sulfonylamino]-N-ethylpropanamide?
3-[(2-cyano-3-pyridinyl)sulfonylamino]-N-ethylpropanamide has a molecular weight of 282.32 g/mol, XLogP of -0.24, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2-cyano-3-pyridinyl)sulfonylamino]-N-ethylpropanamide is sourced from PubChem (CID 106596234), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).