5,7-dimethyl-N-phenylpyrazolo[1,5-a]pyrimidin-2-amine

C14H14N4 — CID 2303250

IUPAC5,7-dimethyl-N-phenylpyrazolo[1,5-a]pyrimidin-2-amine
SMILESCc1cc(C)n2nc(Nc3ccccc3)cc2n1
InChIInChI=1S/C14H14N4/c1-10-8-11(2)18-14(15-10)9-13(17-18)16-12-6-4-3-5-7-12/h3-9H,1-2H3,(H,16,17)
InChIKeyYPPYKGDEXRKFMA-UHFFFAOYSA-N
MW238.29 g/mol
LogP3.09
Rot. Bonds2

About 5,7-dimethyl-N-phenylpyrazolo[1,5-a]pyrimidin-2-amine

5,7-dimethyl-N-phenylpyrazolo[1,5-a]pyrimidin-2-amine (PubChem CID 2303250) has the molecular formula C14H14N4 and a molecular weight of 238.29 g/mol. Its IUPAC name is 5,7-dimethyl-N-phenylpyrazolo[1,5-a]pyrimidin-2-amine.

Molecular Properties

Compound Name5,7-dimethyl-N-phenylpyrazolo[1,5-a]pyrimidin-2-amine
PubChem CID2303250
Molecular FormulaC14H14N4
Molecular Weight238.29 g/mol
Exact Mass238.12
IUPAC Name5,7-dimethyl-N-phenylpyrazolo[1,5-a]pyrimidin-2-amine
SMILESCc1cc(C)n2nc(Nc3ccccc3)cc2n1
InChIInChI=1S/C14H14N4/c1-10-8-11(2)18-14(15-10)9-13(17-18)16-12-6-4-3-5-7-12/h3-9H,1-2H3,(H,16,17)
InChIKeyYPPYKGDEXRKFMA-UHFFFAOYSA-N
XLogP3.09
TPSA42.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5,7-dimethyl-N-phenylpyrazolo[1,5-a]pyrimidin-2-amine?
The IUPAC name of 5,7-dimethyl-N-phenylpyrazolo[1,5-a]pyrimidin-2-amine (CID 2303250) is 5,7-dimethyl-N-phenylpyrazolo[1,5-a]pyrimidin-2-amine.
What is the SMILES notation for 5,7-dimethyl-N-phenylpyrazolo[1,5-a]pyrimidin-2-amine?
The canonical SMILES for 5,7-dimethyl-N-phenylpyrazolo[1,5-a]pyrimidin-2-amine is Cc1cc(C)n2nc(Nc3ccccc3)cc2n1.
What is the InChIKey of 5,7-dimethyl-N-phenylpyrazolo[1,5-a]pyrimidin-2-amine?
The InChIKey is YPPYKGDEXRKFMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N4/c1-10-8-11(2)18-14(15-10)9-13(17-18)16-12-6-4-3-5-7-12/h3-9H,1-2H3,(H,16,17).
What are the key properties of 5,7-dimethyl-N-phenylpyrazolo[1,5-a]pyrimidin-2-amine?
5,7-dimethyl-N-phenylpyrazolo[1,5-a]pyrimidin-2-amine has a molecular weight of 238.29 g/mol, XLogP of 3.09, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5,7-dimethyl-N-phenylpyrazolo[1,5-a]pyrimidin-2-amine is sourced from PubChem (CID 2303250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).