6-(3-methoxyphenyl)-7-methylpyrazolo[1,5-a]pyrimidin-5-amine

C14H14N4O — CID 124908703

IUPAC6-(3-methoxyphenyl)-7-methylpyrazolo[1,5-a]pyrimidin-5-amine
SMILESCOc1cccc(-c2c(N)nc3ccnn3c2C)c1
InChIInChI=1S/C14H14N4O/c1-9-13(10-4-3-5-11(8-10)19-2)14(15)17-12-6-7-16-18(9)12/h3-8H,1-2H3,(H2,15,17)
InChIKeySQOKAQKNCUYTGY-UHFFFAOYSA-N
MW254.29 g/mol
LogP2.30
Rot. Bonds2

About 6-(3-methoxyphenyl)-7-methylpyrazolo[1,5-a]pyrimidin-5-amine

6-(3-methoxyphenyl)-7-methylpyrazolo[1,5-a]pyrimidin-5-amine (PubChem CID 124908703) has the molecular formula C14H14N4O and a molecular weight of 254.29 g/mol. Its IUPAC name is 6-(3-methoxyphenyl)-7-methylpyrazolo[1,5-a]pyrimidin-5-amine.

Molecular Properties

Compound Name6-(3-methoxyphenyl)-7-methylpyrazolo[1,5-a]pyrimidin-5-amine
PubChem CID124908703
Molecular FormulaC14H14N4O
Molecular Weight254.29 g/mol
Exact Mass254.12
IUPAC Name6-(3-methoxyphenyl)-7-methylpyrazolo[1,5-a]pyrimidin-5-amine
SMILESCOc1cccc(-c2c(N)nc3ccnn3c2C)c1
InChIInChI=1S/C14H14N4O/c1-9-13(10-4-3-5-11(8-10)19-2)14(15)17-12-6-7-16-18(9)12/h3-8H,1-2H3,(H2,15,17)
InChIKeySQOKAQKNCUYTGY-UHFFFAOYSA-N
XLogP2.30
TPSA65.44 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.29
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-(3-methoxyphenyl)-7-methylpyrazolo[1,5-a]pyrimidin-5-amine?
The IUPAC name of 6-(3-methoxyphenyl)-7-methylpyrazolo[1,5-a]pyrimidin-5-amine (CID 124908703) is 6-(3-methoxyphenyl)-7-methylpyrazolo[1,5-a]pyrimidin-5-amine.
What is the SMILES notation for 6-(3-methoxyphenyl)-7-methylpyrazolo[1,5-a]pyrimidin-5-amine?
The canonical SMILES for 6-(3-methoxyphenyl)-7-methylpyrazolo[1,5-a]pyrimidin-5-amine is COc1cccc(-c2c(N)nc3ccnn3c2C)c1.
What is the InChIKey of 6-(3-methoxyphenyl)-7-methylpyrazolo[1,5-a]pyrimidin-5-amine?
The InChIKey is SQOKAQKNCUYTGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N4O/c1-9-13(10-4-3-5-11(8-10)19-2)14(15)17-12-6-7-16-18(9)12/h3-8H,1-2H3,(H2,15,17).
What are the key properties of 6-(3-methoxyphenyl)-7-methylpyrazolo[1,5-a]pyrimidin-5-amine?
6-(3-methoxyphenyl)-7-methylpyrazolo[1,5-a]pyrimidin-5-amine has a molecular weight of 254.29 g/mol, XLogP of 2.30, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-methoxyphenyl)-7-methylpyrazolo[1,5-a]pyrimidin-5-amine is sourced from PubChem (CID 124908703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).