7-methoxy-3-(2-methyl-3,4-dihydropyrazol-4-yl)pyrazolo[1,5-a]pyrimidine

C11H13N5O — CID 70995786

IUPAC7-methoxy-3-(2-methyl-3,4-dihydropyrazol-4-yl)pyrazolo[1,5-a]pyrimidine
SMILESCOc1ccnc2c(C3C=NN(C)C3)cnn12
InChIInChI=1S/C11H13N5O/c1-15-7-8(5-13-15)9-6-14-16-10(17-2)3-4-12-11(9)16/h3-6,8H,7H2,1-2H3
InChIKeyVEYNDOXEZWDYRA-UHFFFAOYSA-N
MW231.26 g/mol
LogP0.75
Rot. Bonds2

About 7-methoxy-3-(2-methyl-3,4-dihydropyrazol-4-yl)pyrazolo[1,5-a]pyrimidine

7-methoxy-3-(2-methyl-3,4-dihydropyrazol-4-yl)pyrazolo[1,5-a]pyrimidine (PubChem CID 70995786) has the molecular formula C11H13N5O and a molecular weight of 231.26 g/mol. Its IUPAC name is 7-methoxy-3-(2-methyl-3,4-dihydropyrazol-4-yl)pyrazolo[1,5-a]pyrimidine.

Molecular Properties

Compound Name7-methoxy-3-(2-methyl-3,4-dihydropyrazol-4-yl)pyrazolo[1,5-a]pyrimidine
PubChem CID70995786
Molecular FormulaC11H13N5O
Molecular Weight231.26 g/mol
Exact Mass231.11
IUPAC Name7-methoxy-3-(2-methyl-3,4-dihydropyrazol-4-yl)pyrazolo[1,5-a]pyrimidine
SMILESCOc1ccnc2c(C3C=NN(C)C3)cnn12
InChIInChI=1S/C11H13N5O/c1-15-7-8(5-13-15)9-6-14-16-10(17-2)3-4-12-11(9)16/h3-6,8H,7H2,1-2H3
InChIKeyVEYNDOXEZWDYRA-UHFFFAOYSA-N
XLogP0.75
TPSA55.02 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.26
LogP ≤ 50.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 7-methoxy-3-(2-methyl-3,4-dihydropyrazol-4-yl)pyrazolo[1,5-a]pyrimidine?
The IUPAC name of 7-methoxy-3-(2-methyl-3,4-dihydropyrazol-4-yl)pyrazolo[1,5-a]pyrimidine (CID 70995786) is 7-methoxy-3-(2-methyl-3,4-dihydropyrazol-4-yl)pyrazolo[1,5-a]pyrimidine.
What is the SMILES notation for 7-methoxy-3-(2-methyl-3,4-dihydropyrazol-4-yl)pyrazolo[1,5-a]pyrimidine?
The canonical SMILES for 7-methoxy-3-(2-methyl-3,4-dihydropyrazol-4-yl)pyrazolo[1,5-a]pyrimidine is COc1ccnc2c(C3C=NN(C)C3)cnn12.
What is the InChIKey of 7-methoxy-3-(2-methyl-3,4-dihydropyrazol-4-yl)pyrazolo[1,5-a]pyrimidine?
The InChIKey is VEYNDOXEZWDYRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N5O/c1-15-7-8(5-13-15)9-6-14-16-10(17-2)3-4-12-11(9)16/h3-6,8H,7H2,1-2H3.
What are the key properties of 7-methoxy-3-(2-methyl-3,4-dihydropyrazol-4-yl)pyrazolo[1,5-a]pyrimidine?
7-methoxy-3-(2-methyl-3,4-dihydropyrazol-4-yl)pyrazolo[1,5-a]pyrimidine has a molecular weight of 231.26 g/mol, XLogP of 0.75, 2 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methoxy-3-(2-methyl-3,4-dihydropyrazol-4-yl)pyrazolo[1,5-a]pyrimidine is sourced from PubChem (CID 70995786), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).