3-(2-methoxyphenyl)-2,5,7-trimethylpyrazolo[1,5-a]pyrimidine

C16H17N3O — CID 3156106

IUPAC3-(2-methoxyphenyl)-2,5,7-trimethylpyrazolo[1,5-a]pyrimidine
SMILESCOc1ccccc1-c1c(C)nn2c(C)cc(C)nc12
InChIInChI=1S/C16H17N3O/c1-10-9-11(2)19-16(17-10)15(12(3)18-19)13-7-5-6-8-14(13)20-4/h5-9H,1-4H3
InChIKeyKFWYEWOMDIBCLT-UHFFFAOYSA-N
MW267.33 g/mol
LogP3.33
Rot. Bonds2

About 3-(2-methoxyphenyl)-2,5,7-trimethylpyrazolo[1,5-a]pyrimidine

3-(2-methoxyphenyl)-2,5,7-trimethylpyrazolo[1,5-a]pyrimidine (PubChem CID 3156106) has the molecular formula C16H17N3O and a molecular weight of 267.33 g/mol. Its IUPAC name is 3-(2-methoxyphenyl)-2,5,7-trimethylpyrazolo[1,5-a]pyrimidine.

Molecular Properties

Compound Name3-(2-methoxyphenyl)-2,5,7-trimethylpyrazolo[1,5-a]pyrimidine
PubChem CID3156106
Molecular FormulaC16H17N3O
Molecular Weight267.33 g/mol
Exact Mass267.14
IUPAC Name3-(2-methoxyphenyl)-2,5,7-trimethylpyrazolo[1,5-a]pyrimidine
SMILESCOc1ccccc1-c1c(C)nn2c(C)cc(C)nc12
InChIInChI=1S/C16H17N3O/c1-10-9-11(2)19-16(17-10)15(12(3)18-19)13-7-5-6-8-14(13)20-4/h5-9H,1-4H3
InChIKeyKFWYEWOMDIBCLT-UHFFFAOYSA-N
XLogP3.33
TPSA39.42 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.33
LogP ≤ 53.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

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CID 11595759
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CID 2819135
7-Amino-5-(4-methoxyphenyl)pyrazolo[1,5-a]pyrimidine-3-carbonitrile
CID 70686471
2-(4-Methoxyphenyl)-5,7-dimethylpyrazolo[1,5-a]pyrimidine
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CID 1480420

Frequently Asked Questions

What is the IUPAC name of 3-(2-methoxyphenyl)-2,5,7-trimethylpyrazolo[1,5-a]pyrimidine?
The IUPAC name of 3-(2-methoxyphenyl)-2,5,7-trimethylpyrazolo[1,5-a]pyrimidine (CID 3156106) is 3-(2-methoxyphenyl)-2,5,7-trimethylpyrazolo[1,5-a]pyrimidine.
What is the SMILES notation for 3-(2-methoxyphenyl)-2,5,7-trimethylpyrazolo[1,5-a]pyrimidine?
The canonical SMILES for 3-(2-methoxyphenyl)-2,5,7-trimethylpyrazolo[1,5-a]pyrimidine is COc1ccccc1-c1c(C)nn2c(C)cc(C)nc12.
What is the InChIKey of 3-(2-methoxyphenyl)-2,5,7-trimethylpyrazolo[1,5-a]pyrimidine?
The InChIKey is KFWYEWOMDIBCLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3O/c1-10-9-11(2)19-16(17-10)15(12(3)18-19)13-7-5-6-8-14(13)20-4/h5-9H,1-4H3.
What are the key properties of 3-(2-methoxyphenyl)-2,5,7-trimethylpyrazolo[1,5-a]pyrimidine?
3-(2-methoxyphenyl)-2,5,7-trimethylpyrazolo[1,5-a]pyrimidine has a molecular weight of 267.33 g/mol, XLogP of 3.33, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methoxyphenyl)-2,5,7-trimethylpyrazolo[1,5-a]pyrimidine is sourced from PubChem (CID 3156106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).