N-[(3R)-1-pyridin-2-ylpiperidin-3-yl]pyridine-3-sulfonamide

C15H18N4O2S — CID 124603595

IUPACN-[(3R)-1-pyridin-2-ylpiperidin-3-yl]pyridine-3-sulfonamide
SMILESO=S(=O)(N[C@@H]1CCCN(c2ccccn2)C1)c1cccnc1
InChIInChI=1S/C15H18N4O2S/c20-22(21,14-6-3-8-16-11-14)18-13-5-4-10-19(12-13)15-7-1-2-9-17-15/h1-3,6-9,11,13,18H,4-5,10,12H2/t13-/m1/s1
InChIKeyNPTFODKSGRVDBX-CYBMUJFWSA-N
MW318.40 g/mol
LogP1.42
Rot. Bonds4

About N-[(3R)-1-pyridin-2-ylpiperidin-3-yl]pyridine-3-sulfonamide

N-[(3R)-1-pyridin-2-ylpiperidin-3-yl]pyridine-3-sulfonamide (PubChem CID 124603595) has the molecular formula C15H18N4O2S and a molecular weight of 318.40 g/mol. Its IUPAC name is N-[(3R)-1-pyridin-2-ylpiperidin-3-yl]pyridine-3-sulfonamide.

Molecular Properties

Compound NameN-[(3R)-1-pyridin-2-ylpiperidin-3-yl]pyridine-3-sulfonamide
PubChem CID124603595
Molecular FormulaC15H18N4O2S
Molecular Weight318.40 g/mol
Exact Mass318.12
IUPAC NameN-[(3R)-1-pyridin-2-ylpiperidin-3-yl]pyridine-3-sulfonamide
SMILESO=S(=O)(N[C@@H]1CCCN(c2ccccn2)C1)c1cccnc1
InChIInChI=1S/C15H18N4O2S/c20-22(21,14-6-3-8-16-11-14)18-13-5-4-10-19(12-13)15-7-1-2-9-17-15/h1-3,6-9,11,13,18H,4-5,10,12H2/t13-/m1/s1
InChIKeyNPTFODKSGRVDBX-CYBMUJFWSA-N
XLogP1.42
TPSA75.19 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.40
LogP ≤ 51.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-chloro-N-(1-pyridin-2-ylpyrrolidin-3-yl)benzenesulfonamide
CID 90621517
N-(1-pyridin-2-ylpyrrolidin-3-yl)naphthalene-2-sulfonamide
CID 90621515
N-(1-pyridin-2-ylpyrrolidin-3-yl)quinoline-3-sulfonamide
CID 119049752
4-methoxy-N-(1-pyridin-2-ylpyrrolidin-3-yl)benzenesulfonamide
CID 90621518
4-propan-2-yl-N-(1-pyridin-2-ylpyrrolidin-3-yl)benzenesulfonamide
CID 90621471
N-(1-pyridin-2-ylpyrrolidin-3-yl)cyclopropanesulfonamide
CID 90621445
N-[1-(thiophen-2-ylmethyl)piperidin-3-yl]pyridine-3-sulfonamide
CID 131922128
4-(3-chlorophenyl)-N-[(3S)-1-pyridin-2-ylpyrrolidin-3-yl]benzenesulfonamide
CID 99875676
3-(pyridin-3-ylsulfonylamino)cyclohexane-1-carboxylic acid
CID 55145962
2,3-difluoro-N-(1-pyridin-2-ylpyrrolidin-3-yl)benzenesulfonamide
CID 126768770
N-[1-[[4-(2-methylpropyl)phenyl]methyl]piperidin-3-yl]pyridine-3-sulfonamide
CID 56918189
3-fluoro-4-methoxy-N-(1-pyridin-2-ylpyrrolidin-3-yl)benzenesulfonamide
CID 90621475

Frequently Asked Questions

What is the IUPAC name of N-[(3R)-1-pyridin-2-ylpiperidin-3-yl]pyridine-3-sulfonamide?
The IUPAC name of N-[(3R)-1-pyridin-2-ylpiperidin-3-yl]pyridine-3-sulfonamide (CID 124603595) is N-[(3R)-1-pyridin-2-ylpiperidin-3-yl]pyridine-3-sulfonamide.
What is the SMILES notation for N-[(3R)-1-pyridin-2-ylpiperidin-3-yl]pyridine-3-sulfonamide?
The canonical SMILES for N-[(3R)-1-pyridin-2-ylpiperidin-3-yl]pyridine-3-sulfonamide is O=S(=O)(N[C@@H]1CCCN(c2ccccn2)C1)c1cccnc1.
What is the InChIKey of N-[(3R)-1-pyridin-2-ylpiperidin-3-yl]pyridine-3-sulfonamide?
The InChIKey is NPTFODKSGRVDBX-CYBMUJFWSA-N. The full InChI is InChI=1S/C15H18N4O2S/c20-22(21,14-6-3-8-16-11-14)18-13-5-4-10-19(12-13)15-7-1-2-9-17-15/h1-3,6-9,11,13,18H,4-5,10,12H2/t13-/m1/s1.
What are the key properties of N-[(3R)-1-pyridin-2-ylpiperidin-3-yl]pyridine-3-sulfonamide?
N-[(3R)-1-pyridin-2-ylpiperidin-3-yl]pyridine-3-sulfonamide has a molecular weight of 318.40 g/mol, XLogP of 1.42, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3R)-1-pyridin-2-ylpiperidin-3-yl]pyridine-3-sulfonamide is sourced from PubChem (CID 124603595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).