N-[5-(3-methylpiperidin-1-yl)-2-pyridinyl]propane-1-sulfonamide

C14H23N3O2S — CID 113030836

IUPACN-[5-(3-methylpiperidin-1-yl)-2-pyridinyl]propane-1-sulfonamide
SMILESCCCS(=O)(=O)Nc1ccc(N2CCCC(C)C2)cn1
InChIInChI=1S/C14H23N3O2S/c1-3-9-20(18,19)16-14-7-6-13(10-15-14)17-8-4-5-12(2)11-17/h6-7,10,12H,3-5,8-9,11H2,1-2H3,(H,15,16)
InChIKeyVQHYBLLSYRYJEO-UHFFFAOYSA-N
MW297.42 g/mol
LogP2.47
Rot. Bonds5

About N-[5-(3-methylpiperidin-1-yl)-2-pyridinyl]propane-1-sulfonamide

N-[5-(3-methylpiperidin-1-yl)-2-pyridinyl]propane-1-sulfonamide (PubChem CID 113030836) has the molecular formula C14H23N3O2S and a molecular weight of 297.42 g/mol. Its IUPAC name is N-[5-(3-methylpiperidin-1-yl)-2-pyridinyl]propane-1-sulfonamide.

Molecular Properties

Compound NameN-[5-(3-methylpiperidin-1-yl)-2-pyridinyl]propane-1-sulfonamide
PubChem CID113030836
Molecular FormulaC14H23N3O2S
Molecular Weight297.42 g/mol
Exact Mass297.15
IUPAC NameN-[5-(3-methylpiperidin-1-yl)-2-pyridinyl]propane-1-sulfonamide
SMILESCCCS(=O)(=O)Nc1ccc(N2CCCC(C)C2)cn1
InChIInChI=1S/C14H23N3O2S/c1-3-9-20(18,19)16-14-7-6-13(10-15-14)17-8-4-5-12(2)11-17/h6-7,10,12H,3-5,8-9,11H2,1-2H3,(H,15,16)
InChIKeyVQHYBLLSYRYJEO-UHFFFAOYSA-N
XLogP2.47
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.42
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[5-(3-methylpiperidin-1-yl)-2-pyridinyl]propanamide
CID 113030760
N-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]propane-1-sulfonamide
CID 113025882
N-[5-(3-methylpiperidin-1-yl)-2-pyridinyl]-4-propan-2-ylbenzenesulfonamide
CID 113030849
5-methyl-N-[5-(3-methylpiperidin-1-yl)-2-pyridinyl]thiophene-2-sulfonamide
CID 113030864
N-[5-(4-pyrrolidin-1-ylanilino)-2-pyridinyl]propane-1-sulfonamide
CID 113035669
1-cyclohexyl-3-[5-(3-methylpiperidin-1-yl)-2-pyridinyl]urea
CID 113030823
N-[5-(4-methylpiperidin-1-yl)-2-pyridinyl]methanesulfonamide
CID 113024878
N-[5-(3-methylpiperidin-1-yl)-2-pyridinyl]oxane-4-carboxamide
CID 113030831
N-[6-(4-piperidin-1-ylanilino)-3-pyridinyl]propane-1-sulfonamide
CID 113021072
4-methyl-N-[5-(4-methylpiperidin-1-yl)-2-pyridinyl]benzenesulfonamide
CID 113024884
N-cyclohexyl-5-(3-methylpiperidin-1-yl)pyridine-2-carboxamide
CID 109182975
2-(dimethylsulfamoylamino)-5-pyrrolidin-1-ylpyridine
CID 113024377

Frequently Asked Questions

What is the IUPAC name of N-[5-(3-methylpiperidin-1-yl)-2-pyridinyl]propane-1-sulfonamide?
The IUPAC name of N-[5-(3-methylpiperidin-1-yl)-2-pyridinyl]propane-1-sulfonamide (CID 113030836) is N-[5-(3-methylpiperidin-1-yl)-2-pyridinyl]propane-1-sulfonamide.
What is the SMILES notation for N-[5-(3-methylpiperidin-1-yl)-2-pyridinyl]propane-1-sulfonamide?
The canonical SMILES for N-[5-(3-methylpiperidin-1-yl)-2-pyridinyl]propane-1-sulfonamide is CCCS(=O)(=O)Nc1ccc(N2CCCC(C)C2)cn1.
What is the InChIKey of N-[5-(3-methylpiperidin-1-yl)-2-pyridinyl]propane-1-sulfonamide?
The InChIKey is VQHYBLLSYRYJEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O2S/c1-3-9-20(18,19)16-14-7-6-13(10-15-14)17-8-4-5-12(2)11-17/h6-7,10,12H,3-5,8-9,11H2,1-2H3,(H,15,16).
What are the key properties of N-[5-(3-methylpiperidin-1-yl)-2-pyridinyl]propane-1-sulfonamide?
N-[5-(3-methylpiperidin-1-yl)-2-pyridinyl]propane-1-sulfonamide has a molecular weight of 297.42 g/mol, XLogP of 2.47, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(3-methylpiperidin-1-yl)-2-pyridinyl]propane-1-sulfonamide is sourced from PubChem (CID 113030836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).