N-[(2S)-1-piperidin-1-ylpropan-2-yl]pyridine-3-sulfonamide

C13H21N3O2S — CID 99827269

IUPACN-[(2S)-1-piperidin-1-ylpropan-2-yl]pyridine-3-sulfonamide
SMILESC[C@@H](CN1CCCCC1)NS(=O)(=O)c1cccnc1
InChIInChI=1S/C13H21N3O2S/c1-12(11-16-8-3-2-4-9-16)15-19(17,18)13-6-5-7-14-10-13/h5-7,10,12,15H,2-4,8-9,11H2,1H3/t12-/m0/s1
InChIKeyIDHJFFNPNVMQNB-LBPRGKRZSA-N
MW283.40 g/mol
LogP1.23
Rot. Bonds5

About N-[(2S)-1-piperidin-1-ylpropan-2-yl]pyridine-3-sulfonamide

N-[(2S)-1-piperidin-1-ylpropan-2-yl]pyridine-3-sulfonamide (PubChem CID 99827269) has the molecular formula C13H21N3O2S and a molecular weight of 283.40 g/mol. Its IUPAC name is N-[(2S)-1-piperidin-1-ylpropan-2-yl]pyridine-3-sulfonamide.

Molecular Properties

Compound NameN-[(2S)-1-piperidin-1-ylpropan-2-yl]pyridine-3-sulfonamide
PubChem CID99827269
Molecular FormulaC13H21N3O2S
Molecular Weight283.40 g/mol
Exact Mass283.14
IUPAC NameN-[(2S)-1-piperidin-1-ylpropan-2-yl]pyridine-3-sulfonamide
SMILESC[C@@H](CN1CCCCC1)NS(=O)(=O)c1cccnc1
InChIInChI=1S/C13H21N3O2S/c1-12(11-16-8-3-2-4-9-16)15-19(17,18)13-6-5-7-14-10-13/h5-7,10,12,15H,2-4,8-9,11H2,1H3/t12-/m0/s1
InChIKeyIDHJFFNPNVMQNB-LBPRGKRZSA-N
XLogP1.23
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.40
LogP ≤ 51.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[(2S)-1-piperidin-1-ylpropan-2-yl]pyridine-3-sulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[(2S)-1-piperidin-1-ylpropan-2-yl]pyridine-3-sulfonamide?
The IUPAC name of N-[(2S)-1-piperidin-1-ylpropan-2-yl]pyridine-3-sulfonamide (CID 99827269) is N-[(2S)-1-piperidin-1-ylpropan-2-yl]pyridine-3-sulfonamide.
What is the SMILES notation for N-[(2S)-1-piperidin-1-ylpropan-2-yl]pyridine-3-sulfonamide?
The canonical SMILES for N-[(2S)-1-piperidin-1-ylpropan-2-yl]pyridine-3-sulfonamide is C[C@@H](CN1CCCCC1)NS(=O)(=O)c1cccnc1.
What is the InChIKey of N-[(2S)-1-piperidin-1-ylpropan-2-yl]pyridine-3-sulfonamide?
The InChIKey is IDHJFFNPNVMQNB-LBPRGKRZSA-N. The full InChI is InChI=1S/C13H21N3O2S/c1-12(11-16-8-3-2-4-9-16)15-19(17,18)13-6-5-7-14-10-13/h5-7,10,12,15H,2-4,8-9,11H2,1H3/t12-/m0/s1.
What are the key properties of N-[(2S)-1-piperidin-1-ylpropan-2-yl]pyridine-3-sulfonamide?
N-[(2S)-1-piperidin-1-ylpropan-2-yl]pyridine-3-sulfonamide has a molecular weight of 283.40 g/mol, XLogP of 1.23, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2S)-1-piperidin-1-ylpropan-2-yl]pyridine-3-sulfonamide is sourced from PubChem (CID 99827269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).