8-(4-methylsulfonylphenyl)imidazo[1,5-c]pyrimidin-5-amine

C13H12N4O2S — CID 139346299

IUPAC8-(4-methylsulfonylphenyl)imidazo[1,5-c]pyrimidin-5-amine
SMILESCS(=O)(=O)c1ccc(-c2cnc(N)n3cncc23)cc1
InChIInChI=1S/C13H12N4O2S/c1-20(18,19)10-4-2-9(3-5-10)11-6-16-13(14)17-8-15-7-12(11)17/h2-8H,1H3,(H2,14,16)
InChIKeyVVMIZIVARXBCCP-UHFFFAOYSA-N
MW288.33 g/mol
LogP1.38
Rot. Bonds2

About 8-(4-methylsulfonylphenyl)imidazo[1,5-c]pyrimidin-5-amine

8-(4-methylsulfonylphenyl)imidazo[1,5-c]pyrimidin-5-amine (PubChem CID 139346299) has the molecular formula C13H12N4O2S and a molecular weight of 288.33 g/mol. Its IUPAC name is 8-(4-methylsulfonylphenyl)imidazo[1,5-c]pyrimidin-5-amine.

Molecular Properties

Compound Name8-(4-methylsulfonylphenyl)imidazo[1,5-c]pyrimidin-5-amine
PubChem CID139346299
Molecular FormulaC13H12N4O2S
Molecular Weight288.33 g/mol
Exact Mass288.07
IUPAC Name8-(4-methylsulfonylphenyl)imidazo[1,5-c]pyrimidin-5-amine
SMILESCS(=O)(=O)c1ccc(-c2cnc(N)n3cncc23)cc1
InChIInChI=1S/C13H12N4O2S/c1-20(18,19)10-4-2-9(3-5-10)11-6-16-13(14)17-8-15-7-12(11)17/h2-8H,1H3,(H2,14,16)
InChIKeyVVMIZIVARXBCCP-UHFFFAOYSA-N
XLogP1.38
TPSA90.35 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.33
LogP ≤ 51.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-methyl-5-[4-(4-methylsulfonylphenyl)furan-3-yl]pyridine
CID 22181944
methyl 2-amino-5-(4-methylsulfonylphenyl)pyridine-4-carboxylate
CID 172649603
5-(4-methylsulfonylphenyl)-1,7,9-triazatricyclo[4.3.0.02,8]nona-2,4,6,8-tetraene
CID 67481414
4-(4-methylsulfonylphenyl)pyridine
CID 119085244
(1S)-1-[3-(4-methylsulfonylphenyl)imidazol-4-yl]ethanamine
CID 104942096
1-methyl-5-(4-methylsulfonylphenyl)pyrazol-4-amine
CID 83727845
2-(5-methyl-2-pyridinyl)-3-(4-methylsulfonylphenyl)pyrazolo[1,5-a]pyridine
CID 139886821
N,N-dimethyl-4-[3-(4-methylsulfonylphenyl)imidazol-4-yl]aniline
CID 22600055
3-(4-methylsulfonylphenyl)imidazo[1,2-a]pyrazine
CID 157020249
3-[4-(methoxymethoxy)phenyl]-5-(4-methylsulfonylphenyl)pyridin-2-amine
CID 155561849
3-(4-methylsulfonylphenyl)-5-[3-(trifluoromethyl)phenyl]pyrazolo[1,5-a]pyridine
CID 122193258
2-chloro-5-methyl-3-(4-methylsulfonylphenyl)pyridine
CID 15380940

Frequently Asked Questions

What is the IUPAC name of 8-(4-methylsulfonylphenyl)imidazo[1,5-c]pyrimidin-5-amine?
The IUPAC name of 8-(4-methylsulfonylphenyl)imidazo[1,5-c]pyrimidin-5-amine (CID 139346299) is 8-(4-methylsulfonylphenyl)imidazo[1,5-c]pyrimidin-5-amine.
What is the SMILES notation for 8-(4-methylsulfonylphenyl)imidazo[1,5-c]pyrimidin-5-amine?
The canonical SMILES for 8-(4-methylsulfonylphenyl)imidazo[1,5-c]pyrimidin-5-amine is CS(=O)(=O)c1ccc(-c2cnc(N)n3cncc23)cc1.
What is the InChIKey of 8-(4-methylsulfonylphenyl)imidazo[1,5-c]pyrimidin-5-amine?
The InChIKey is VVMIZIVARXBCCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12N4O2S/c1-20(18,19)10-4-2-9(3-5-10)11-6-16-13(14)17-8-15-7-12(11)17/h2-8H,1H3,(H2,14,16).
What are the key properties of 8-(4-methylsulfonylphenyl)imidazo[1,5-c]pyrimidin-5-amine?
8-(4-methylsulfonylphenyl)imidazo[1,5-c]pyrimidin-5-amine has a molecular weight of 288.33 g/mol, XLogP of 1.38, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(4-methylsulfonylphenyl)imidazo[1,5-c]pyrimidin-5-amine is sourced from PubChem (CID 139346299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).