3-[(2-chloro-3-pyridinyl)sulfonylamino]-N-cyclopropylpropanamide

C11H14ClN3O3S — CID 113220281

IUPAC3-[(2-chloro-3-pyridinyl)sulfonylamino]-N-cyclopropylpropanamide
SMILESO=C(CCNS(=O)(=O)c1cccnc1Cl)NC1CC1
InChIInChI=1S/C11H14ClN3O3S/c12-11-9(2-1-6-13-11)19(17,18)14-7-5-10(16)15-8-3-4-8/h1-2,6,8,14H,3-5,7H2,(H,15,16)
InChIKeyASZIERSRTYITQM-UHFFFAOYSA-N
MW303.77 g/mol
LogP0.68
Rot. Bonds6

About 3-[(2-chloro-3-pyridinyl)sulfonylamino]-N-cyclopropylpropanamide

3-[(2-chloro-3-pyridinyl)sulfonylamino]-N-cyclopropylpropanamide (PubChem CID 113220281) has the molecular formula C11H14ClN3O3S and a molecular weight of 303.77 g/mol. Its IUPAC name is 3-[(2-chloro-3-pyridinyl)sulfonylamino]-N-cyclopropylpropanamide.

Molecular Properties

Compound Name3-[(2-chloro-3-pyridinyl)sulfonylamino]-N-cyclopropylpropanamide
PubChem CID113220281
Molecular FormulaC11H14ClN3O3S
Molecular Weight303.77 g/mol
Exact Mass303.04
IUPAC Name3-[(2-chloro-3-pyridinyl)sulfonylamino]-N-cyclopropylpropanamide
SMILESO=C(CCNS(=O)(=O)c1cccnc1Cl)NC1CC1
InChIInChI=1S/C11H14ClN3O3S/c12-11-9(2-1-6-13-11)19(17,18)14-7-5-10(16)15-8-3-4-8/h1-2,6,8,14H,3-5,7H2,(H,15,16)
InChIKeyASZIERSRTYITQM-UHFFFAOYSA-N
XLogP0.68
TPSA88.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.77
LogP ≤ 50.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

ethyl 3-[(2-chloro-3-pyridinyl)sulfonylamino]propanoate
CID 55207055
N-cyclopropyl-3-[(3-methylsulfonyl-2-pyridinyl)amino]propanamide
CID 114598969
2-chloro-N-(2-cyclohexylethyl)pyridine-3-sulfonamide
CID 54932567
3-[(4-chloro-2-fluorophenyl)sulfonylamino]-N-cyclohexylpropanamide
CID 55914836
2-chloro-N-cyclobutylpyridine-3-sulfonamide
CID 62414188
(2S)-4-[(2-chloro-3-pyridinyl)sulfonylamino]-2-hydroxybutanoic acid
CID 104934121
N-cyclopropyl-2-[[2-(methylamino)-3-pyridinyl]sulfonylamino]acetamide
CID 62146294
3-(benzenesulfonamido)-N-cyclohexylpropanamide
CID 17225810
4-[(3-chloro-2-pyridinyl)amino]-N-cyclopropylbutanamide
CID 79401819
2-[(2-carbamothioyl-3-pyridinyl)sulfonylamino]-N-cyclopropylacetamide
CID 106596660
N-cyclopropyl-4-[(3-methylsulfonyl-2-pyridinyl)amino]butanamide
CID 114598970
2-chloro-N-[3-(2-methoxyethoxy)propyl]pyridine-3-sulfonamide
CID 61250348

Frequently Asked Questions

What is the IUPAC name of 3-[(2-chloro-3-pyridinyl)sulfonylamino]-N-cyclopropylpropanamide?
The IUPAC name of 3-[(2-chloro-3-pyridinyl)sulfonylamino]-N-cyclopropylpropanamide (CID 113220281) is 3-[(2-chloro-3-pyridinyl)sulfonylamino]-N-cyclopropylpropanamide.
What is the SMILES notation for 3-[(2-chloro-3-pyridinyl)sulfonylamino]-N-cyclopropylpropanamide?
The canonical SMILES for 3-[(2-chloro-3-pyridinyl)sulfonylamino]-N-cyclopropylpropanamide is O=C(CCNS(=O)(=O)c1cccnc1Cl)NC1CC1.
What is the InChIKey of 3-[(2-chloro-3-pyridinyl)sulfonylamino]-N-cyclopropylpropanamide?
The InChIKey is ASZIERSRTYITQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14ClN3O3S/c12-11-9(2-1-6-13-11)19(17,18)14-7-5-10(16)15-8-3-4-8/h1-2,6,8,14H,3-5,7H2,(H,15,16).
What are the key properties of 3-[(2-chloro-3-pyridinyl)sulfonylamino]-N-cyclopropylpropanamide?
3-[(2-chloro-3-pyridinyl)sulfonylamino]-N-cyclopropylpropanamide has a molecular weight of 303.77 g/mol, XLogP of 0.68, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2-chloro-3-pyridinyl)sulfonylamino]-N-cyclopropylpropanamide is sourced from PubChem (CID 113220281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).