(2R)-2-[4-(2-ethylpyrazol-3-yl)-6-methylpyrimidin-2-yl]-N,N-dimethylpyrrolidine-1-sulfonamide

C16H24N6O2S — CID 125026555

IUPAC(2R)-2-[4-(2-ethylpyrazol-3-yl)-6-methylpyrimidin-2-yl]-N,N-dimethylpyrrolidine-1-sulfonamide
SMILESCCn1nccc1-c1cc(C)nc([C@H]2CCCN2S(=O)(=O)N(C)C)n1
InChIInChI=1S/C16H24N6O2S/c1-5-21-14(8-9-17-21)13-11-12(2)18-16(19-13)15-7-6-10-22(15)25(23,24)20(3)4/h8-9,11,15H,5-7,10H2,1-4H3/t15-/m1/s1
InChIKeyZUMDJPAOAQTBLE-OAHLLOKOSA-N
MW364.48 g/mol
LogP1.61
Rot. Bonds5

About (2R)-2-[4-(2-ethylpyrazol-3-yl)-6-methylpyrimidin-2-yl]-N,N-dimethylpyrrolidine-1-sulfonamide

(2R)-2-[4-(2-ethylpyrazol-3-yl)-6-methylpyrimidin-2-yl]-N,N-dimethylpyrrolidine-1-sulfonamide (PubChem CID 125026555) has the molecular formula C16H24N6O2S and a molecular weight of 364.48 g/mol. Its IUPAC name is (2R)-2-[4-(2-ethylpyrazol-3-yl)-6-methylpyrimidin-2-yl]-N,N-dimethylpyrrolidine-1-sulfonamide.

Molecular Properties

Compound Name(2R)-2-[4-(2-ethylpyrazol-3-yl)-6-methylpyrimidin-2-yl]-N,N-dimethylpyrrolidine-1-sulfonamide
PubChem CID125026555
Molecular FormulaC16H24N6O2S
Molecular Weight364.48 g/mol
Exact Mass364.17
IUPAC Name(2R)-2-[4-(2-ethylpyrazol-3-yl)-6-methylpyrimidin-2-yl]-N,N-dimethylpyrrolidine-1-sulfonamide
SMILESCCn1nccc1-c1cc(C)nc([C@H]2CCCN2S(=O)(=O)N(C)C)n1
InChIInChI=1S/C16H24N6O2S/c1-5-21-14(8-9-17-21)13-11-12(2)18-16(19-13)15-7-6-10-22(15)25(23,24)20(3)4/h8-9,11,15H,5-7,10H2,1-4H3/t15-/m1/s1
InChIKeyZUMDJPAOAQTBLE-OAHLLOKOSA-N
XLogP1.61
TPSA84.22 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.48
LogP ≤ 51.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze (2R)-2-[4-(2-ethylpyrazol-3-yl)-6-methylpyrimidin-2-yl]-N,N-dimethylpyrrolidine-1-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 (2R)-2-[4-(2-ethylpyrazol-3-yl)-6-methylpyrimidin-2-yl]-N,N-dimethylpyrrolidine-1-sulfonamide?
The IUPAC name of (2R)-2-[4-(2-ethylpyrazol-3-yl)-6-methylpyrimidin-2-yl]-N,N-dimethylpyrrolidine-1-sulfonamide (CID 125026555) is (2R)-2-[4-(2-ethylpyrazol-3-yl)-6-methylpyrimidin-2-yl]-N,N-dimethylpyrrolidine-1-sulfonamide.
What is the SMILES notation for (2R)-2-[4-(2-ethylpyrazol-3-yl)-6-methylpyrimidin-2-yl]-N,N-dimethylpyrrolidine-1-sulfonamide?
The canonical SMILES for (2R)-2-[4-(2-ethylpyrazol-3-yl)-6-methylpyrimidin-2-yl]-N,N-dimethylpyrrolidine-1-sulfonamide is CCn1nccc1-c1cc(C)nc([C@H]2CCCN2S(=O)(=O)N(C)C)n1.
What is the InChIKey of (2R)-2-[4-(2-ethylpyrazol-3-yl)-6-methylpyrimidin-2-yl]-N,N-dimethylpyrrolidine-1-sulfonamide?
The InChIKey is ZUMDJPAOAQTBLE-OAHLLOKOSA-N. The full InChI is InChI=1S/C16H24N6O2S/c1-5-21-14(8-9-17-21)13-11-12(2)18-16(19-13)15-7-6-10-22(15)25(23,24)20(3)4/h8-9,11,15H,5-7,10H2,1-4H3/t15-/m1/s1.
What are the key properties of (2R)-2-[4-(2-ethylpyrazol-3-yl)-6-methylpyrimidin-2-yl]-N,N-dimethylpyrrolidine-1-sulfonamide?
(2R)-2-[4-(2-ethylpyrazol-3-yl)-6-methylpyrimidin-2-yl]-N,N-dimethylpyrrolidine-1-sulfonamide has a molecular weight of 364.48 g/mol, XLogP of 1.61, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-[4-(2-ethylpyrazol-3-yl)-6-methylpyrimidin-2-yl]-N,N-dimethylpyrrolidine-1-sulfonamide is sourced from PubChem (CID 125026555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).