2-(3-pyrrolidin-1-ylsulfonylphenyl)imidazo[1,2-a]pyrimidine

C16H16N4O2S — CID 938226

IUPAC2-(3-pyrrolidin-1-ylsulfonylphenyl)imidazo[1,2-a]pyrimidine
SMILESO=S(=O)(c1cccc(-c2cn3cccnc3n2)c1)N1CCCC1
InChIInChI=1S/C16H16N4O2S/c21-23(22,20-9-1-2-10-20)14-6-3-5-13(11-14)15-12-19-8-4-7-17-16(19)18-15/h3-8,11-12H,1-2,9-10H2
InChIKeyUQJPHBBTGAPTDW-UHFFFAOYSA-N
MW328.40 g/mol
LogP2.18
Rot. Bonds3

About 2-(3-pyrrolidin-1-ylsulfonylphenyl)imidazo[1,2-a]pyrimidine

2-(3-pyrrolidin-1-ylsulfonylphenyl)imidazo[1,2-a]pyrimidine (PubChem CID 938226) has the molecular formula C16H16N4O2S and a molecular weight of 328.40 g/mol. Its IUPAC name is 2-(3-pyrrolidin-1-ylsulfonylphenyl)imidazo[1,2-a]pyrimidine.

Molecular Properties

Compound Name2-(3-pyrrolidin-1-ylsulfonylphenyl)imidazo[1,2-a]pyrimidine
PubChem CID938226
Molecular FormulaC16H16N4O2S
Molecular Weight328.40 g/mol
Exact Mass328.10
IUPAC Name2-(3-pyrrolidin-1-ylsulfonylphenyl)imidazo[1,2-a]pyrimidine
SMILESO=S(=O)(c1cccc(-c2cn3cccnc3n2)c1)N1CCCC1
InChIInChI=1S/C16H16N4O2S/c21-23(22,20-9-1-2-10-20)14-6-3-5-13(11-14)15-12-19-8-4-7-17-16(19)18-15/h3-8,11-12H,1-2,9-10H2
InChIKeyUQJPHBBTGAPTDW-UHFFFAOYSA-N
XLogP2.18
TPSA67.57 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.40
LogP ≤ 52.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 2-(3-pyrrolidin-1-ylsulfonylphenyl)imidazo[1,2-a]pyrimidine with MolForge

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

Launch Full Analysis

Related Compounds

2-[3-(3-methylpiperidin-1-yl)sulfonylphenyl]imidazo[1,2-a]pyrimidine
CID 664590
8-methyl-2-(3-pyrrolidin-1-ylsulfonylphenyl)imidazo[1,2-a]pyridine
CID 935997
2-(3-pyrrolidin-1-ylsulfonylphenyl)pyridin-3-ol
CID 53218283
3-chloro-4-fluoro-N-(3-imidazo[1,2-a]pyrimidin-2-ylphenyl)benzenesulfonamide
CID 122285186
2-phenyl-4-(3-piperidin-1-ylsulfonylphenyl)-1,3-thiazole
CID 1034342
2-pyridin-3-ylimidazo[1,2-a]pyrimidine
CID 10035574
2-fluoro-N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)-5-morpholin-4-ylsulfonylbenzamide
CID 55826797
2,6-difluoro-N-(3-imidazo[1,2-a]pyrimidin-2-ylphenyl)benzenesulfonamide
CID 122285192
1-(2-fluorophenyl)-N-(3-imidazo[1,2-a]pyrimidin-2-ylphenyl)methanesulfonamide
CID 122285217
3-(3-pyrrolidin-1-ylsulfonylphenyl)phenol
CID 53218745
3-fluoro-N-(5-imidazo[1,2-a]pyrimidin-2-yl-2-methoxyphenyl)benzenesulfonamide
CID 121024205
7-methyl-2-[3-[(3R)-3-methylpiperidin-1-yl]sulfonylphenyl]imidazo[1,2-a]pyridine
CID 7903354

Frequently Asked Questions

What is the IUPAC name of 2-(3-pyrrolidin-1-ylsulfonylphenyl)imidazo[1,2-a]pyrimidine?
The IUPAC name of 2-(3-pyrrolidin-1-ylsulfonylphenyl)imidazo[1,2-a]pyrimidine (CID 938226) is 2-(3-pyrrolidin-1-ylsulfonylphenyl)imidazo[1,2-a]pyrimidine.
What is the SMILES notation for 2-(3-pyrrolidin-1-ylsulfonylphenyl)imidazo[1,2-a]pyrimidine?
The canonical SMILES for 2-(3-pyrrolidin-1-ylsulfonylphenyl)imidazo[1,2-a]pyrimidine is O=S(=O)(c1cccc(-c2cn3cccnc3n2)c1)N1CCCC1.
What is the InChIKey of 2-(3-pyrrolidin-1-ylsulfonylphenyl)imidazo[1,2-a]pyrimidine?
The InChIKey is UQJPHBBTGAPTDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N4O2S/c21-23(22,20-9-1-2-10-20)14-6-3-5-13(11-14)15-12-19-8-4-7-17-16(19)18-15/h3-8,11-12H,1-2,9-10H2.
What are the key properties of 2-(3-pyrrolidin-1-ylsulfonylphenyl)imidazo[1,2-a]pyrimidine?
2-(3-pyrrolidin-1-ylsulfonylphenyl)imidazo[1,2-a]pyrimidine has a molecular weight of 328.40 g/mol, XLogP of 2.18, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-pyrrolidin-1-ylsulfonylphenyl)imidazo[1,2-a]pyrimidine is sourced from PubChem (CID 938226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).