7-methyl-6-pyridin-2-ylpyrazolo[1,5-a]pyrimidine-3,5-dicarbonitrile

C14H8N6 — CID 25022674

IUPAC7-methyl-6-pyridin-2-ylpyrazolo[1,5-a]pyrimidine-3,5-dicarbonitrile
SMILESCc1c(-c2ccccn2)c(C#N)nc2c(C#N)cnn12
InChIInChI=1S/C14H8N6/c1-9-13(11-4-2-3-5-17-11)12(7-16)19-14-10(6-15)8-18-20(9)14/h2-5,8H,1H3
InChIKeyWQJNHDRVLAGWEU-UHFFFAOYSA-N
MW260.26 g/mol
LogP1.84
Rot. Bonds1

About 7-methyl-6-pyridin-2-ylpyrazolo[1,5-a]pyrimidine-3,5-dicarbonitrile

7-methyl-6-pyridin-2-ylpyrazolo[1,5-a]pyrimidine-3,5-dicarbonitrile (PubChem CID 25022674) has the molecular formula C14H8N6 and a molecular weight of 260.26 g/mol. Its IUPAC name is 7-methyl-6-pyridin-2-ylpyrazolo[1,5-a]pyrimidine-3,5-dicarbonitrile.

Molecular Properties

Compound Name7-methyl-6-pyridin-2-ylpyrazolo[1,5-a]pyrimidine-3,5-dicarbonitrile
PubChem CID25022674
Molecular FormulaC14H8N6
Molecular Weight260.26 g/mol
Exact Mass260.08
IUPAC Name7-methyl-6-pyridin-2-ylpyrazolo[1,5-a]pyrimidine-3,5-dicarbonitrile
SMILESCc1c(-c2ccccn2)c(C#N)nc2c(C#N)cnn12
InChIInChI=1S/C14H8N6/c1-9-13(11-4-2-3-5-17-11)12(7-16)19-14-10(6-15)8-18-20(9)14/h2-5,8H,1H3
InChIKeyWQJNHDRVLAGWEU-UHFFFAOYSA-N
XLogP1.84
TPSA90.66 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.26
LogP ≤ 51.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

4,5-dimethyl-6-pyridin-2-ylpyridine-2,3-dicarbonitrile
CID 18716383
5-methyl-7-phenylpyrazolo[1,5-a]pyrimidine-3-carbonitrile
CID 1079878
5,7-dichloro-6-(4-methylphenyl)pyrazolo[1,5-a]pyrimidine-3-carbonitrile
CID 114514531
2-[[4-(methylamino)cyclohexyl]amino]-4-[(4-pyridin-2-ylphenyl)methylamino]pyrazolo[1,5-a][1,3,5]triazine-8-carbonitrile
CID 176916863
7-propan-2-ylpyrazolo[1,5-a]pyrimidine-3-carbonitrile
CID 84660602
6-methyl-4-pyridin-2-ylpyridine-3-carbonitrile
CID 82112135
2-(dimethylamino)-4-pyridin-2-ylpyrimidine-5-carbonitrile
CID 73439061
5,7-dichloro-6-[3-(trifluoromethyl)-2-pyridinyl]pyrazolo[1,5-a]pyrimidine-3-carbonitrile
CID 11653355
2-(5-methyl-2-pyridinyl)-4,6-dipyridin-2-yl-1,3,5-triazine
CID 58261693
5,7-dichloro-6-(2-fluorophenyl)pyrazolo[1,5-a]pyrimidine-3-carbonitrile
CID 114514536
2-methyl-4-phenyl-3-pyridin-2-ylbenzonitrile
CID 156678731
7-amino-5-phenylpyrazolo[1,5-a]pyrimidine-3,6-dicarbonitrile
CID 14950768

Frequently Asked Questions

What is the IUPAC name of 7-methyl-6-pyridin-2-ylpyrazolo[1,5-a]pyrimidine-3,5-dicarbonitrile?
The IUPAC name of 7-methyl-6-pyridin-2-ylpyrazolo[1,5-a]pyrimidine-3,5-dicarbonitrile (CID 25022674) is 7-methyl-6-pyridin-2-ylpyrazolo[1,5-a]pyrimidine-3,5-dicarbonitrile.
What is the SMILES notation for 7-methyl-6-pyridin-2-ylpyrazolo[1,5-a]pyrimidine-3,5-dicarbonitrile?
The canonical SMILES for 7-methyl-6-pyridin-2-ylpyrazolo[1,5-a]pyrimidine-3,5-dicarbonitrile is Cc1c(-c2ccccn2)c(C#N)nc2c(C#N)cnn12.
What is the InChIKey of 7-methyl-6-pyridin-2-ylpyrazolo[1,5-a]pyrimidine-3,5-dicarbonitrile?
The InChIKey is WQJNHDRVLAGWEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H8N6/c1-9-13(11-4-2-3-5-17-11)12(7-16)19-14-10(6-15)8-18-20(9)14/h2-5,8H,1H3.
What are the key properties of 7-methyl-6-pyridin-2-ylpyrazolo[1,5-a]pyrimidine-3,5-dicarbonitrile?
7-methyl-6-pyridin-2-ylpyrazolo[1,5-a]pyrimidine-3,5-dicarbonitrile has a molecular weight of 260.26 g/mol, XLogP of 1.84, 1 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-6-pyridin-2-ylpyrazolo[1,5-a]pyrimidine-3,5-dicarbonitrile is sourced from PubChem (CID 25022674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).