(3R)-1-[5-(diethylsulfamoyl)-2-pyridinyl]pyrrolidine-3-carboxamide

C14H22N4O3S — CID 94434130

IUPAC(3R)-1-[5-(diethylsulfamoyl)-2-pyridinyl]pyrrolidine-3-carboxamide
SMILESCCN(CC)S(=O)(=O)c1ccc(N2CC[C@@H](C(N)=O)C2)nc1
InChIInChI=1S/C14H22N4O3S/c1-3-18(4-2)22(20,21)12-5-6-13(16-9-12)17-8-7-11(10-17)14(15)19/h5-6,9,11H,3-4,7-8,10H2,1-2H3,(H2,15,19)/t11-/m1/s1
InChIKeyYSGANURKEXQFFM-LLVKDONJSA-N
MW326.42 g/mol
LogP0.42
Rot. Bonds6

About (3R)-1-[5-(diethylsulfamoyl)-2-pyridinyl]pyrrolidine-3-carboxamide

(3R)-1-[5-(diethylsulfamoyl)-2-pyridinyl]pyrrolidine-3-carboxamide (PubChem CID 94434130) has the molecular formula C14H22N4O3S and a molecular weight of 326.42 g/mol. Its IUPAC name is (3R)-1-[5-(diethylsulfamoyl)-2-pyridinyl]pyrrolidine-3-carboxamide.

Molecular Properties

Compound Name(3R)-1-[5-(diethylsulfamoyl)-2-pyridinyl]pyrrolidine-3-carboxamide
PubChem CID94434130
Molecular FormulaC14H22N4O3S
Molecular Weight326.42 g/mol
Exact Mass326.14
IUPAC Name(3R)-1-[5-(diethylsulfamoyl)-2-pyridinyl]pyrrolidine-3-carboxamide
SMILESCCN(CC)S(=O)(=O)c1ccc(N2CC[C@@H](C(N)=O)C2)nc1
InChIInChI=1S/C14H22N4O3S/c1-3-18(4-2)22(20,21)12-5-6-13(16-9-12)17-8-7-11(10-17)14(15)19/h5-6,9,11H,3-4,7-8,10H2,1-2H3,(H2,15,19)/t11-/m1/s1
InChIKeyYSGANURKEXQFFM-LLVKDONJSA-N
XLogP0.42
TPSA96.60 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.42
LogP ≤ 50.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(3R)-1-[5-[di(propan-2-yl)sulfamoyl]-2-pyridinyl]piperidine-3-carboxamide
CID 51969113
1-[5-[ethyl(phenyl)sulfamoyl]-2-pyridinyl]piperidine-4-carboxamide
CID 4816078
(3R)-1-[5-(3-methylbutylsulfamoyl)-2-pyridinyl]pyrrolidine-3-carboxamide
CID 95327429
N,N-diethyl-6-(4-methylsulfonylpiperazin-1-yl)pyridine-3-sulfonamide
CID 24525934
1-[5-(dimethylsulfamoyl)-2-pyridinyl]piperidine-4-carboxylic acid
CID 103340811
6-(4-benzoylpiperazin-1-yl)-N,N-diethylpyridine-3-sulfonamide
CID 4878483
1-(5-methyl-2-pyridinyl)piperidine-3-carboxamide
CID 90309940
N,N-diethyl-6-[4-(2-fluorophenyl)piperazin-1-yl]pyridine-3-sulfonamide
CID 4877422
6-[3-(1H-benzimidazol-2-yl)piperidin-1-yl]-N,N-diethylpyridine-3-sulfonamide
CID 24606904
(3R)-1-(5-nitro-2-pyridinyl)piperidine-3-carboxamide
CID 30994170
(3S)-1-(5-amino-2-pyridinyl)piperidine-3-carboxamide
CID 30115330
1-[5-[(1-methylsulfonylpiperidine-4-carbonyl)amino]-2-pyridinyl]piperidine-3-carboxamide
CID 55700725

Frequently Asked Questions

What is the IUPAC name of (3R)-1-[5-(diethylsulfamoyl)-2-pyridinyl]pyrrolidine-3-carboxamide?
The IUPAC name of (3R)-1-[5-(diethylsulfamoyl)-2-pyridinyl]pyrrolidine-3-carboxamide (CID 94434130) is (3R)-1-[5-(diethylsulfamoyl)-2-pyridinyl]pyrrolidine-3-carboxamide.
What is the SMILES notation for (3R)-1-[5-(diethylsulfamoyl)-2-pyridinyl]pyrrolidine-3-carboxamide?
The canonical SMILES for (3R)-1-[5-(diethylsulfamoyl)-2-pyridinyl]pyrrolidine-3-carboxamide is CCN(CC)S(=O)(=O)c1ccc(N2CC[C@@H](C(N)=O)C2)nc1.
What is the InChIKey of (3R)-1-[5-(diethylsulfamoyl)-2-pyridinyl]pyrrolidine-3-carboxamide?
The InChIKey is YSGANURKEXQFFM-LLVKDONJSA-N. The full InChI is InChI=1S/C14H22N4O3S/c1-3-18(4-2)22(20,21)12-5-6-13(16-9-12)17-8-7-11(10-17)14(15)19/h5-6,9,11H,3-4,7-8,10H2,1-2H3,(H2,15,19)/t11-/m1/s1.
What are the key properties of (3R)-1-[5-(diethylsulfamoyl)-2-pyridinyl]pyrrolidine-3-carboxamide?
(3R)-1-[5-(diethylsulfamoyl)-2-pyridinyl]pyrrolidine-3-carboxamide has a molecular weight of 326.42 g/mol, XLogP of 0.42, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-1-[5-(diethylsulfamoyl)-2-pyridinyl]pyrrolidine-3-carboxamide is sourced from PubChem (CID 94434130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).