2-methyl-6-methylsulfonylpyrazolo[1,5-a]pyrimidin-7-amine

C8H10N4O2S — CID 1477912

IUPAC2-methyl-6-methylsulfonylpyrazolo[1,5-a]pyrimidin-7-amine
SMILESCc1cc2ncc(S(C)(=O)=O)c(N)n2n1
InChIInChI=1S/C8H10N4O2S/c1-5-3-7-10-4-6(15(2,13)14)8(9)12(7)11-5/h3-4H,9H2,1-2H3
InChIKeyLSOQEMDMIIKUNI-UHFFFAOYSA-N
MW226.26 g/mol
LogP0.02
Rot. Bonds1

About 2-methyl-6-methylsulfonylpyrazolo[1,5-a]pyrimidin-7-amine

2-methyl-6-methylsulfonylpyrazolo[1,5-a]pyrimidin-7-amine (PubChem CID 1477912) has the molecular formula C8H10N4O2S and a molecular weight of 226.26 g/mol. Its IUPAC name is 2-methyl-6-methylsulfonylpyrazolo[1,5-a]pyrimidin-7-amine.

Molecular Properties

Compound Name2-methyl-6-methylsulfonylpyrazolo[1,5-a]pyrimidin-7-amine
PubChem CID1477912
Molecular FormulaC8H10N4O2S
Molecular Weight226.26 g/mol
Exact Mass226.05
IUPAC Name2-methyl-6-methylsulfonylpyrazolo[1,5-a]pyrimidin-7-amine
SMILESCc1cc2ncc(S(C)(=O)=O)c(N)n2n1
InChIInChI=1S/C8H10N4O2S/c1-5-3-7-10-4-6(15(2,13)14)8(9)12(7)11-5/h3-4H,9H2,1-2H3
InChIKeyLSOQEMDMIIKUNI-UHFFFAOYSA-N
XLogP0.02
TPSA90.35 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.26
LogP ≤ 50.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

CID 2819516
CID 2819516
CID 1480446
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CID 6467341
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CID 17843994
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CID 14422514
CID 14422514
CID 56886063
CID 56886063
CID 70757443
CID 70757443
CID 85875653
CID 85875653
CID 18071327
CID 18071327
CID 54593561
CID 54593561
CID 165990859
CID 165990859
CID 2819517
CID 2819517

Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-methylsulfonylpyrazolo[1,5-a]pyrimidin-7-amine?
The IUPAC name of 2-methyl-6-methylsulfonylpyrazolo[1,5-a]pyrimidin-7-amine (CID 1477912) is 2-methyl-6-methylsulfonylpyrazolo[1,5-a]pyrimidin-7-amine.
What is the SMILES notation for 2-methyl-6-methylsulfonylpyrazolo[1,5-a]pyrimidin-7-amine?
The canonical SMILES for 2-methyl-6-methylsulfonylpyrazolo[1,5-a]pyrimidin-7-amine is Cc1cc2ncc(S(C)(=O)=O)c(N)n2n1.
What is the InChIKey of 2-methyl-6-methylsulfonylpyrazolo[1,5-a]pyrimidin-7-amine?
The InChIKey is LSOQEMDMIIKUNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N4O2S/c1-5-3-7-10-4-6(15(2,13)14)8(9)12(7)11-5/h3-4H,9H2,1-2H3.
What are the key properties of 2-methyl-6-methylsulfonylpyrazolo[1,5-a]pyrimidin-7-amine?
2-methyl-6-methylsulfonylpyrazolo[1,5-a]pyrimidin-7-amine has a molecular weight of 226.26 g/mol, XLogP of 0.02, 1 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-methylsulfonylpyrazolo[1,5-a]pyrimidin-7-amine is sourced from PubChem (CID 1477912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).