6-methyl-4-(3-methylpyrazol-1-yl)-1H-pyrazolo[5,4-d]pyrimidine

C10H10N6 — CID 178105173

IUPAC6-methyl-4-(3-methylpyrazol-1-yl)-1H-pyrazolo[5,4-d]pyrimidine
SMILESCc1ccn(-c2nc(C)nc3[nH]ncc23)n1
InChIInChI=1S/C10H10N6/c1-6-3-4-16(15-6)10-8-5-11-14-9(8)12-7(2)13-10/h3-5H,1-2H3,(H,11,12,13,14)
InChIKeyNXYCNCVRCXQLLG-UHFFFAOYSA-N
MW214.23 g/mol
LogP1.16
Rot. Bonds1

About 6-methyl-4-(3-methylpyrazol-1-yl)-1H-pyrazolo[5,4-d]pyrimidine

6-methyl-4-(3-methylpyrazol-1-yl)-1H-pyrazolo[5,4-d]pyrimidine (PubChem CID 178105173) has the molecular formula C10H10N6 and a molecular weight of 214.23 g/mol. Its IUPAC name is 6-methyl-4-(3-methylpyrazol-1-yl)-1H-pyrazolo[5,4-d]pyrimidine.

Molecular Properties

Compound Name6-methyl-4-(3-methylpyrazol-1-yl)-1H-pyrazolo[5,4-d]pyrimidine
PubChem CID178105173
Molecular FormulaC10H10N6
Molecular Weight214.23 g/mol
Exact Mass214.10
IUPAC Name6-methyl-4-(3-methylpyrazol-1-yl)-1H-pyrazolo[5,4-d]pyrimidine
SMILESCc1ccn(-c2nc(C)nc3[nH]ncc23)n1
InChIInChI=1S/C10H10N6/c1-6-3-4-16(15-6)10-8-5-11-14-9(8)12-7(2)13-10/h3-5H,1-2H3,(H,11,12,13,14)
InChIKeyNXYCNCVRCXQLLG-UHFFFAOYSA-N
XLogP1.16
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 ≤ 51.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(1h-Pyrazol-4-Yl)-5h-Pyrrolo[2,3-B]pyrazine
CID 90105293
N-(5-methyl-1H-pyrazol-3-yl)-6-piperazin-1-yl-1H-pyrazolo[5,4-d]pyrimidin-4-amine
CID 168237681
4-N-(5-methyl-1H-pyrazol-3-yl)-6-N-pyrrolidin-3-yl-1H-pyrazolo[5,4-d]pyrimidine-4,6-diamine
CID 168273113
4-N-(5-methyl-1H-pyrazol-3-yl)-6-N-piperidin-4-yl-1H-pyrazolo[5,4-d]pyrimidine-4,6-diamine
CID 168281071
5,8-dimethyl-2-[(E)-2-[2-methyl-5-(1H-pyrazol-5-yl)-1,2,4-triazol-3-yl]ethenyl]-[1,2,4]triazolo[1,5-a]pyrazine
CID 165415127
6-chloro-N-(5-methyl-1H-pyrazol-3-yl)-1H-pyrazolo[5,4-d]pyrimidin-4-amine
CID 168274831
5-Ethyl-N,2,3-trimethyl-N-(1H-pyrazol-3-ylmethyl)pyrazolo[1,5-A]pyrimidin-7-amine
CID 56913193
5,6-Dimethylpyrazolo[1,5-A]pyrimidine
CID 49761390
(5-Methylpyrazolo[1,5-a]pyrimidin-7-yl)hydrazine
CID 12281653
N-[(2-ethylpyrazol-3-yl)methyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine
CID 52104010
N-(1-ethyl-5-methylpyrazol-4-yl)-1H-pyrazolo[5,4-d]pyrimidin-4-amine
CID 52104028
N-[(1-ethyl-5-methylpyrazol-4-yl)methyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine
CID 52104029

Frequently Asked Questions

What is the IUPAC name of 6-methyl-4-(3-methylpyrazol-1-yl)-1H-pyrazolo[5,4-d]pyrimidine?
The IUPAC name of 6-methyl-4-(3-methylpyrazol-1-yl)-1H-pyrazolo[5,4-d]pyrimidine (CID 178105173) is 6-methyl-4-(3-methylpyrazol-1-yl)-1H-pyrazolo[5,4-d]pyrimidine.
What is the SMILES notation for 6-methyl-4-(3-methylpyrazol-1-yl)-1H-pyrazolo[5,4-d]pyrimidine?
The canonical SMILES for 6-methyl-4-(3-methylpyrazol-1-yl)-1H-pyrazolo[5,4-d]pyrimidine is Cc1ccn(-c2nc(C)nc3[nH]ncc23)n1.
What is the InChIKey of 6-methyl-4-(3-methylpyrazol-1-yl)-1H-pyrazolo[5,4-d]pyrimidine?
The InChIKey is NXYCNCVRCXQLLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N6/c1-6-3-4-16(15-6)10-8-5-11-14-9(8)12-7(2)13-10/h3-5H,1-2H3,(H,11,12,13,14).
What are the key properties of 6-methyl-4-(3-methylpyrazol-1-yl)-1H-pyrazolo[5,4-d]pyrimidine?
6-methyl-4-(3-methylpyrazol-1-yl)-1H-pyrazolo[5,4-d]pyrimidine has a molecular weight of 214.23 g/mol, XLogP of 1.16, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-4-(3-methylpyrazol-1-yl)-1H-pyrazolo[5,4-d]pyrimidine is sourced from PubChem (CID 178105173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).