N-(2-methyl-3-piperidin-1-ylpropyl)-6-oxo-1H-pyridine-3-sulfonamide

C14H23N3O3S — CID 61020791

IUPACN-(2-methyl-3-piperidin-1-ylpropyl)-6-oxo-1H-pyridine-3-sulfonamide
SMILESCC(CNS(=O)(=O)c1ccc(=O)[nH]c1)CN1CCCCC1
InChIInChI=1S/C14H23N3O3S/c1-12(11-17-7-3-2-4-8-17)9-16-21(19,20)13-5-6-14(18)15-10-13/h5-6,10,12,16H,2-4,7-9,11H2,1H3,(H,15,18)
InChIKeyQCUIZHGQQCWYNO-UHFFFAOYSA-N
MW313.42 g/mol
LogP0.78
Rot. Bonds6

About N-(2-methyl-3-piperidin-1-ylpropyl)-6-oxo-1H-pyridine-3-sulfonamide

N-(2-methyl-3-piperidin-1-ylpropyl)-6-oxo-1H-pyridine-3-sulfonamide (PubChem CID 61020791) has the molecular formula C14H23N3O3S and a molecular weight of 313.42 g/mol. Its IUPAC name is N-(2-methyl-3-piperidin-1-ylpropyl)-6-oxo-1H-pyridine-3-sulfonamide.

Molecular Properties

Compound NameN-(2-methyl-3-piperidin-1-ylpropyl)-6-oxo-1H-pyridine-3-sulfonamide
PubChem CID61020791
Molecular FormulaC14H23N3O3S
Molecular Weight313.42 g/mol
Exact Mass313.15
IUPAC NameN-(2-methyl-3-piperidin-1-ylpropyl)-6-oxo-1H-pyridine-3-sulfonamide
SMILESCC(CNS(=O)(=O)c1ccc(=O)[nH]c1)CN1CCCCC1
InChIInChI=1S/C14H23N3O3S/c1-12(11-17-7-3-2-4-8-17)9-16-21(19,20)13-5-6-14(18)15-10-13/h5-6,10,12,16H,2-4,7-9,11H2,1H3,(H,15,18)
InChIKeyQCUIZHGQQCWYNO-UHFFFAOYSA-N
XLogP0.78
TPSA82.27 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.42
LogP ≤ 50.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-ethylsulfonyl-N-[(2R)-2-methyl-3-piperidin-1-ylpropyl]benzenesulfonamide
CID 51966450
N-(2-methylpropyl)-6-oxo-1H-pyridine-3-sulfonamide
CID 43629041
6-chloro-N-(2-methyl-3-piperidin-1-ylpropyl)pyridine-3-sulfonamide
CID 61045800
4-ethoxy-N-(2-methyl-3-pyrrolidin-1-ylpropyl)benzenesulfonamide
CID 47062275
N-(2-methyl-3-pyrrolidin-1-ylpropyl)-1H-pyrazole-4-sulfonamide
CID 47372669
N-(3-methyl-2-propan-2-ylbutyl)-6-oxo-1H-pyridine-3-sulfonamide
CID 102907510
3-bromo-N-(2-methyl-3-piperidin-1-ylpropyl)benzenesulfonamide
CID 61060155
N-(2-methyl-3-piperidin-1-ylpropyl)-6-oxo-1H-pyridine-3-carboxamide
CID 47292410
3-amino-4-bromo-N-(2-methyl-3-pyrrolidin-1-ylpropyl)benzenesulfonamide
CID 115329291
4-fluoro-N-[2-methyl-3-(4-methylpiperazin-1-yl)propyl]benzenesulfonamide
CID 60530804
N-[(2S)-2-methyl-3-pyrrolidin-1-ylpropyl]-2,3-dihydro-1-benzofuran-5-sulfonamide
CID 94605722
1-bromo-N-(2-methyl-3-piperidin-1-ylpropyl)methanesulfonamide
CID 83086462

Frequently Asked Questions

What is the IUPAC name of N-(2-methyl-3-piperidin-1-ylpropyl)-6-oxo-1H-pyridine-3-sulfonamide?
The IUPAC name of N-(2-methyl-3-piperidin-1-ylpropyl)-6-oxo-1H-pyridine-3-sulfonamide (CID 61020791) is N-(2-methyl-3-piperidin-1-ylpropyl)-6-oxo-1H-pyridine-3-sulfonamide.
What is the SMILES notation for N-(2-methyl-3-piperidin-1-ylpropyl)-6-oxo-1H-pyridine-3-sulfonamide?
The canonical SMILES for N-(2-methyl-3-piperidin-1-ylpropyl)-6-oxo-1H-pyridine-3-sulfonamide is CC(CNS(=O)(=O)c1ccc(=O)[nH]c1)CN1CCCCC1.
What is the InChIKey of N-(2-methyl-3-piperidin-1-ylpropyl)-6-oxo-1H-pyridine-3-sulfonamide?
The InChIKey is QCUIZHGQQCWYNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O3S/c1-12(11-17-7-3-2-4-8-17)9-16-21(19,20)13-5-6-14(18)15-10-13/h5-6,10,12,16H,2-4,7-9,11H2,1H3,(H,15,18).
What are the key properties of N-(2-methyl-3-piperidin-1-ylpropyl)-6-oxo-1H-pyridine-3-sulfonamide?
N-(2-methyl-3-piperidin-1-ylpropyl)-6-oxo-1H-pyridine-3-sulfonamide has a molecular weight of 313.42 g/mol, XLogP of 0.78, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methyl-3-piperidin-1-ylpropyl)-6-oxo-1H-pyridine-3-sulfonamide is sourced from PubChem (CID 61020791), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).