2-ethyl-3,5,6,7-tetramethylpyrazolo[1,5-a]pyrimidine

C12H17N3 — CID 703981

IUPAC2-ethyl-3,5,6,7-tetramethylpyrazolo[1,5-a]pyrimidine
SMILESCCc1nn2c(C)c(C)c(C)nc2c1C
InChIInChI=1S/C12H17N3/c1-6-11-8(3)12-13-9(4)7(2)10(5)15(12)14-11/h6H2,1-5H3
InChIKeyJNKMYDXGDXAMJD-UHFFFAOYSA-N
MW203.29 g/mol
LogP2.53
Rot. Bonds1

About 2-ethyl-3,5,6,7-tetramethylpyrazolo[1,5-a]pyrimidine

2-ethyl-3,5,6,7-tetramethylpyrazolo[1,5-a]pyrimidine (PubChem CID 703981) has the molecular formula C12H17N3 and a molecular weight of 203.29 g/mol. Its IUPAC name is 2-ethyl-3,5,6,7-tetramethylpyrazolo[1,5-a]pyrimidine.

Molecular Properties

Compound Name2-ethyl-3,5,6,7-tetramethylpyrazolo[1,5-a]pyrimidine
PubChem CID703981
Molecular FormulaC12H17N3
Molecular Weight203.29 g/mol
Exact Mass203.14
IUPAC Name2-ethyl-3,5,6,7-tetramethylpyrazolo[1,5-a]pyrimidine
SMILESCCc1nn2c(C)c(C)c(C)nc2c1C
InChIInChI=1S/C12H17N3/c1-6-11-8(3)12-13-9(4)7(2)10(5)15(12)14-11/h6H2,1-5H3
InChIKeyJNKMYDXGDXAMJD-UHFFFAOYSA-N
XLogP2.53
TPSA30.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.29
LogP ≤ 52.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2,5,7-Trimethylpyrazolo[1,5-a]pyrimidine
CID 3611062
2,5-Di-tert-butylpyrazolo[1,5-a]pyrimidin-7-amine
CID 2060523
2,5-dimethyl-7,8-dihydro-6H-cyclopenta[e]pyrazolo[1,5-a]pyrimidine
CID 1477871
5-Tert-butyl-2-methylpyrazolo[1,5-a]pyrimidin-7-amine
CID 974687
3-chloro-2,5-dimethyl-7,8-dihydro-6H-cyclopenta[e]pyrazolo[1,5-a]pyrimidine
CID 1477880
3-bromo-2,5-dimethyl-7,8-dihydro-6H-cyclopenta[e]pyrazolo[1,5-a]pyrimidine
CID 1477882
7-(Tert-butyl)-1,2,3,4-tetrahydropyrazolo[1,5-a][1,3,5]triazine-2,4-diimine
CID 2801306
5-Methyl-2-propan-2-yl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine
CID 2821597
Pyrazolo(1,5-a)-1,3,5-triazine-2,4-diamine, 7-ethyl-8-methyl-, hydrochloride, hydrate
CID 3054720
2-(Cyanomethyl)-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carbonitrile
CID 230936
1,2,3,7,8,9-Hexahydrocyclopenta[d]cyclopenta[3,4]pyrazolo[1,5-a]pyrimidin-6-amine
CID 3163254
4,7-Dimethyl-3-propan-2-yl-1,3,8,10,12-pentazatricyclo[7.3.0.02,6]dodeca-2(6),7,9,11-tetraene
CID 12671190

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-3,5,6,7-tetramethylpyrazolo[1,5-a]pyrimidine?
The IUPAC name of 2-ethyl-3,5,6,7-tetramethylpyrazolo[1,5-a]pyrimidine (CID 703981) is 2-ethyl-3,5,6,7-tetramethylpyrazolo[1,5-a]pyrimidine.
What is the SMILES notation for 2-ethyl-3,5,6,7-tetramethylpyrazolo[1,5-a]pyrimidine?
The canonical SMILES for 2-ethyl-3,5,6,7-tetramethylpyrazolo[1,5-a]pyrimidine is CCc1nn2c(C)c(C)c(C)nc2c1C.
What is the InChIKey of 2-ethyl-3,5,6,7-tetramethylpyrazolo[1,5-a]pyrimidine?
The InChIKey is JNKMYDXGDXAMJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N3/c1-6-11-8(3)12-13-9(4)7(2)10(5)15(12)14-11/h6H2,1-5H3.
What are the key properties of 2-ethyl-3,5,6,7-tetramethylpyrazolo[1,5-a]pyrimidine?
2-ethyl-3,5,6,7-tetramethylpyrazolo[1,5-a]pyrimidine has a molecular weight of 203.29 g/mol, XLogP of 2.53, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-3,5,6,7-tetramethylpyrazolo[1,5-a]pyrimidine is sourced from PubChem (CID 703981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).