5-amino-7-methylsulfonylimidazo[1,2-c]pyrimidine-2-carboxylic acid

C8H8N4O4S — CID 82380639

IUPAC5-amino-7-methylsulfonylimidazo[1,2-c]pyrimidine-2-carboxylic acid
SMILESCS(=O)(=O)c1cc2nc(C(=O)O)cn2c(N)n1
InChIInChI=1S/C8H8N4O4S/c1-17(15,16)6-2-5-10-4(7(13)14)3-12(5)8(9)11-6/h2-3H,1H3,(H2,9,11)(H,13,14)
InChIKeyMWBPVLKPTBWZCZ-UHFFFAOYSA-N
MW256.24 g/mol
LogP-0.59
Rot. Bonds2

About 5-amino-7-methylsulfonylimidazo[1,2-c]pyrimidine-2-carboxylic acid

5-amino-7-methylsulfonylimidazo[1,2-c]pyrimidine-2-carboxylic acid (PubChem CID 82380639) has the molecular formula C8H8N4O4S and a molecular weight of 256.24 g/mol. Its IUPAC name is 5-amino-7-methylsulfonylimidazo[1,2-c]pyrimidine-2-carboxylic acid.

Molecular Properties

Compound Name5-amino-7-methylsulfonylimidazo[1,2-c]pyrimidine-2-carboxylic acid
PubChem CID82380639
Molecular FormulaC8H8N4O4S
Molecular Weight256.24 g/mol
Exact Mass256.03
IUPAC Name5-amino-7-methylsulfonylimidazo[1,2-c]pyrimidine-2-carboxylic acid
SMILESCS(=O)(=O)c1cc2nc(C(=O)O)cn2c(N)n1
InChIInChI=1S/C8H8N4O4S/c1-17(15,16)6-2-5-10-4(7(13)14)3-12(5)8(9)11-6/h2-3H,1H3,(H2,9,11)(H,13,14)
InChIKeyMWBPVLKPTBWZCZ-UHFFFAOYSA-N
XLogP-0.59
TPSA127.65 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.24
LogP ≤ 5-0.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

6-methylsulfonylpyrazine-2-carboxylic acid
CID 119030966
4,6-diamino-5-(methanesulfonamido)pyridine-2-carboxylic acid
CID 5278297
1-ethyl-2-(methylsulfonylmethyl)imidazole-4-carboxylic acid
CID 117187592
CID 89161252
CID 89161252
5-ethoxycarbonylimidazo[1,2-a]pyridine-2-carboxylic acid
CID 155820424
4-tert-butyl-6-methylsulfonylpyrimidine-2-carboxylic acid
CID 83825692
2-ethyl-6-methylsulfonylpyridine-4-carboxylic acid
CID 84692631
5-chloro-8-methoxyimidazo[1,2-a]quinoline-2-carboxylic acid
CID 12763969
3-ethylimidazo[2,1-b][1,3]thiazole-6-carboxylic acid
CID 55265116
6,7-dimethylimidazo[2,1-b][1,3]benzothiazole-2-carboxylic acid
CID 10243643
8-(trifluoromethyl)imidazo[1,2-a]quinoline-2-carboxylic acid
CID 14067488
imidazo[1,2-a]pyridine-2,7-dicarboxylic acid
CID 19701499

Frequently Asked Questions

What is the IUPAC name of 5-amino-7-methylsulfonylimidazo[1,2-c]pyrimidine-2-carboxylic acid?
The IUPAC name of 5-amino-7-methylsulfonylimidazo[1,2-c]pyrimidine-2-carboxylic acid (CID 82380639) is 5-amino-7-methylsulfonylimidazo[1,2-c]pyrimidine-2-carboxylic acid.
What is the SMILES notation for 5-amino-7-methylsulfonylimidazo[1,2-c]pyrimidine-2-carboxylic acid?
The canonical SMILES for 5-amino-7-methylsulfonylimidazo[1,2-c]pyrimidine-2-carboxylic acid is CS(=O)(=O)c1cc2nc(C(=O)O)cn2c(N)n1.
What is the InChIKey of 5-amino-7-methylsulfonylimidazo[1,2-c]pyrimidine-2-carboxylic acid?
The InChIKey is MWBPVLKPTBWZCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8N4O4S/c1-17(15,16)6-2-5-10-4(7(13)14)3-12(5)8(9)11-6/h2-3H,1H3,(H2,9,11)(H,13,14).
What are the key properties of 5-amino-7-methylsulfonylimidazo[1,2-c]pyrimidine-2-carboxylic acid?
5-amino-7-methylsulfonylimidazo[1,2-c]pyrimidine-2-carboxylic acid has a molecular weight of 256.24 g/mol, XLogP of -0.59, 2 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-7-methylsulfonylimidazo[1,2-c]pyrimidine-2-carboxylic acid is sourced from PubChem (CID 82380639), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).