2-[(3R)-3-morpholin-4-ylsulfonylpiperidin-1-yl]pyridine-3-carbonitrile

C15H20N4O3S — CID 97344026

IUPAC2-[(3R)-3-morpholin-4-ylsulfonylpiperidin-1-yl]pyridine-3-carbonitrile
SMILESN#Cc1cccnc1N1CCC[C@@H](S(=O)(=O)N2CCOCC2)C1
InChIInChI=1S/C15H20N4O3S/c16-11-13-3-1-5-17-15(13)18-6-2-4-14(12-18)23(20,21)19-7-9-22-10-8-19/h1,3,5,14H,2,4,6-10,12H2/t14-/m1/s1
InChIKeyJHGAOOXOGKGGBB-CQSZACIVSA-N
MW336.42 g/mol
LogP0.58
Rot. Bonds3

About 2-[(3R)-3-morpholin-4-ylsulfonylpiperidin-1-yl]pyridine-3-carbonitrile

2-[(3R)-3-morpholin-4-ylsulfonylpiperidin-1-yl]pyridine-3-carbonitrile (PubChem CID 97344026) has the molecular formula C15H20N4O3S and a molecular weight of 336.42 g/mol. Its IUPAC name is 2-[(3R)-3-morpholin-4-ylsulfonylpiperidin-1-yl]pyridine-3-carbonitrile.

Molecular Properties

Compound Name2-[(3R)-3-morpholin-4-ylsulfonylpiperidin-1-yl]pyridine-3-carbonitrile
PubChem CID97344026
Molecular FormulaC15H20N4O3S
Molecular Weight336.42 g/mol
Exact Mass336.13
IUPAC Name2-[(3R)-3-morpholin-4-ylsulfonylpiperidin-1-yl]pyridine-3-carbonitrile
SMILESN#Cc1cccnc1N1CCC[C@@H](S(=O)(=O)N2CCOCC2)C1
InChIInChI=1S/C15H20N4O3S/c16-11-13-3-1-5-17-15(13)18-6-2-4-14(12-18)23(20,21)19-7-9-22-10-8-19/h1,3,5,14H,2,4,6-10,12H2/t14-/m1/s1
InChIKeyJHGAOOXOGKGGBB-CQSZACIVSA-N
XLogP0.58
TPSA86.53 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.42
LogP ≤ 50.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

2-(6-cyclobutyl-1,4-oxazepan-4-yl)pyridine-3-carbonitrile
CID 166225727
2-[3-[methyl-(4-morpholin-4-ylpyrimidin-2-yl)amino]piperidin-1-yl]pyridine-3-carbonitrile
CID 171994800
2-[(3S)-3-(2-methyl-6-morpholin-4-ylpyrimidin-4-yl)piperidin-1-yl]pyridine-3-carbonitrile
CID 95882703
2-[3-(methoxymethyl)piperidin-1-yl]pyridine-3-carbonitrile
CID 113235312
2-(3-azabicyclo[4.1.0]heptan-3-yl)pyridine-3-carbonitrile
CID 117045417
2-(4-methylazepan-1-yl)pyridine-3-carbonitrile
CID 55210322
N-[2-[1-(3-cyano-2-pyridinyl)piperidin-3-yl]ethyl]-N-(oxan-4-yl)formamide
CID 143229666
2-[4-(3-morpholin-4-ylsulfonylbenzoyl)piperazin-1-yl]pyridine-3-carbonitrile
CID 55455428
2-[4-(oxolan-3-yl)piperidin-1-yl]pyridine-3-carbonitrile
CID 166209187
2-[3-(2-oxoimidazolidin-1-yl)piperidin-1-yl]pyridine-3-carbonitrile
CID 47079116
2-[3-(piperidine-1-carbonyl)pyrrolidin-1-yl]pyridine-3-carbonitrile
CID 166602458
2-(4-aminopiperidin-1-yl)pyridine-3-carbonitrile;trihydrochloride
CID 163329752

Frequently Asked Questions

What is the IUPAC name of 2-[(3R)-3-morpholin-4-ylsulfonylpiperidin-1-yl]pyridine-3-carbonitrile?
The IUPAC name of 2-[(3R)-3-morpholin-4-ylsulfonylpiperidin-1-yl]pyridine-3-carbonitrile (CID 97344026) is 2-[(3R)-3-morpholin-4-ylsulfonylpiperidin-1-yl]pyridine-3-carbonitrile.
What is the SMILES notation for 2-[(3R)-3-morpholin-4-ylsulfonylpiperidin-1-yl]pyridine-3-carbonitrile?
The canonical SMILES for 2-[(3R)-3-morpholin-4-ylsulfonylpiperidin-1-yl]pyridine-3-carbonitrile is N#Cc1cccnc1N1CCC[C@@H](S(=O)(=O)N2CCOCC2)C1.
What is the InChIKey of 2-[(3R)-3-morpholin-4-ylsulfonylpiperidin-1-yl]pyridine-3-carbonitrile?
The InChIKey is JHGAOOXOGKGGBB-CQSZACIVSA-N. The full InChI is InChI=1S/C15H20N4O3S/c16-11-13-3-1-5-17-15(13)18-6-2-4-14(12-18)23(20,21)19-7-9-22-10-8-19/h1,3,5,14H,2,4,6-10,12H2/t14-/m1/s1.
What are the key properties of 2-[(3R)-3-morpholin-4-ylsulfonylpiperidin-1-yl]pyridine-3-carbonitrile?
2-[(3R)-3-morpholin-4-ylsulfonylpiperidin-1-yl]pyridine-3-carbonitrile has a molecular weight of 336.42 g/mol, XLogP of 0.58, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3R)-3-morpholin-4-ylsulfonylpiperidin-1-yl]pyridine-3-carbonitrile is sourced from PubChem (CID 97344026), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).