8-(2,5-dimethylpyrazol-3-yl)-7H-purine

C10H10N6 — CID 136989215

IUPAC8-(2,5-dimethylpyrazol-3-yl)-7H-purine
SMILESCc1cc(-c2nc3ncncc3[nH]2)n(C)n1
InChIInChI=1S/C10H10N6/c1-6-3-8(16(2)15-6)10-13-7-4-11-5-12-9(7)14-10/h3-5H,1-2H3,(H,11,12,13,14)
InChIKeyTYCYKCSOMNONST-UHFFFAOYSA-N
MW214.23 g/mol
LogP1.06
Rot. Bonds1

About 8-(2,5-dimethylpyrazol-3-yl)-7H-purine

8-(2,5-dimethylpyrazol-3-yl)-7H-purine (PubChem CID 136989215) has the molecular formula C10H10N6 and a molecular weight of 214.23 g/mol. Its IUPAC name is 8-(2,5-dimethylpyrazol-3-yl)-7H-purine.

Molecular Properties

Compound Name8-(2,5-dimethylpyrazol-3-yl)-7H-purine
PubChem CID136989215
Molecular FormulaC10H10N6
Molecular Weight214.23 g/mol
Exact Mass214.10
IUPAC Name8-(2,5-dimethylpyrazol-3-yl)-7H-purine
SMILESCc1cc(-c2nc3ncncc3[nH]2)n(C)n1
InChIInChI=1S/C10H10N6/c1-6-3-8(16(2)15-6)10-13-7-4-11-5-12-9(7)14-10/h3-5H,1-2H3,(H,11,12,13,14)
InChIKeyTYCYKCSOMNONST-UHFFFAOYSA-N
XLogP1.06
TPSA72.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.23
LogP ≤ 51.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-methyl-5-(7H-purin-8-yl)pyrrol-3-amine
CID 71104814
8-(2,5-dimethylpyrazol-3-yl)-7H-purin-6-amine
CID 137003605
8-(5-methylfuran-3-yl)-7H-purine
CID 114821646
8-(3-methylthiophen-2-yl)-7H-purine
CID 114402599
4-methyl-5-(7H-purin-8-yl)-1,3-thiazole
CID 114402555
8-(4-methylsulfanylphenyl)-7H-purine
CID 114402617
8-(3,4,5-trimethoxyphenyl)-7H-purine
CID 114402745
8-(3-chloro-4-methylthiophen-2-yl)-7H-purine
CID 103402885
8-(5-bromo-3-pyridinyl)-7H-purine
CID 114402746
2,6-dichloro-4-(7H-purin-8-yl)aniline
CID 114402139
4-(7H-purin-8-yl)pyridin-2-amine
CID 114402124
2-(7H-purin-8-yl)-1,3-thiazole
CID 67998499

Frequently Asked Questions

What is the IUPAC name of 8-(2,5-dimethylpyrazol-3-yl)-7H-purine?
The IUPAC name of 8-(2,5-dimethylpyrazol-3-yl)-7H-purine (CID 136989215) is 8-(2,5-dimethylpyrazol-3-yl)-7H-purine.
What is the SMILES notation for 8-(2,5-dimethylpyrazol-3-yl)-7H-purine?
The canonical SMILES for 8-(2,5-dimethylpyrazol-3-yl)-7H-purine is Cc1cc(-c2nc3ncncc3[nH]2)n(C)n1.
What is the InChIKey of 8-(2,5-dimethylpyrazol-3-yl)-7H-purine?
The InChIKey is TYCYKCSOMNONST-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N6/c1-6-3-8(16(2)15-6)10-13-7-4-11-5-12-9(7)14-10/h3-5H,1-2H3,(H,11,12,13,14).
What are the key properties of 8-(2,5-dimethylpyrazol-3-yl)-7H-purine?
8-(2,5-dimethylpyrazol-3-yl)-7H-purine has a molecular weight of 214.23 g/mol, XLogP of 1.06, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(2,5-dimethylpyrazol-3-yl)-7H-purine is sourced from PubChem (CID 136989215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).