7-methyl-3-phenylpyrazolo[1,5-a]pyrimidin-5-amine

C13H12N4 — CID 105481983

IUPAC7-methyl-3-phenylpyrazolo[1,5-a]pyrimidin-5-amine
SMILESCc1cc(N)nc2c(-c3ccccc3)cnn12
InChIInChI=1S/C13H12N4/c1-9-7-12(14)16-13-11(8-15-17(9)13)10-5-3-2-4-6-10/h2-8H,1H3,(H2,14,16)
InChIKeyICPRFIJLZFJRTR-UHFFFAOYSA-N
MW224.27 g/mol
LogP2.29
Rot. Bonds1

About 7-methyl-3-phenylpyrazolo[1,5-a]pyrimidin-5-amine

7-methyl-3-phenylpyrazolo[1,5-a]pyrimidin-5-amine (PubChem CID 105481983) has the molecular formula C13H12N4 and a molecular weight of 224.27 g/mol. Its IUPAC name is 7-methyl-3-phenylpyrazolo[1,5-a]pyrimidin-5-amine.

Molecular Properties

Compound Name7-methyl-3-phenylpyrazolo[1,5-a]pyrimidin-5-amine
PubChem CID105481983
Molecular FormulaC13H12N4
Molecular Weight224.27 g/mol
Exact Mass224.11
IUPAC Name7-methyl-3-phenylpyrazolo[1,5-a]pyrimidin-5-amine
SMILESCc1cc(N)nc2c(-c3ccccc3)cnn12
InChIInChI=1S/C13H12N4/c1-9-7-12(14)16-13-11(8-15-17(9)13)10-5-3-2-4-6-10/h2-8H,1H3,(H2,14,16)
InChIKeyICPRFIJLZFJRTR-UHFFFAOYSA-N
XLogP2.29
TPSA56.21 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.27
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-ethyl-7-methylpyrazolo[1,5-a]pyrimidin-5-amine
CID 145164018
3-(3-chlorophenyl)-5,7-dimethylpyrazolo[1,5-a]pyrimidine
CID 6500069
3-(4-fluorophenyl)-5-methyl-6-phenylpyrazolo[1,5-a]pyrimidin-7-amine
CID 1472663
7-(4-fluorophenyl)-5-methyl-3-phenylpyrazolo[1,5-a]pyrimidine
CID 42640807
7-tert-butyl-5,6-dimethyl-3-phenylpyrazolo[1,5-a]pyrimidine
CID 617088
5,7-dimethyl-3-thiophen-2-ylpyrazolo[1,5-a]pyrimidine
CID 51345972
N-(3,4-dimethylphenyl)-5-methyl-3-phenylpyrazolo[1,5-a]pyrimidin-7-amine
CID 4304394
N-(4-fluorophenyl)-5-methyl-3-phenylpyrazolo[1,5-a]pyrimidin-7-amine
CID 3333332
5,6-dimethyl-3-phenyl-7-piperidin-1-ylpyrazolo[1,5-a]pyrimidine
CID 8741392
7-(benzimidazol-1-yl)-5-methyl-3-phenylpyrazolo[1,5-a]pyrimidine
CID 3817354
N-(3,4-dichlorophenyl)-5-methyl-3-phenylpyrazolo[1,5-a]pyrimidin-7-amine
CID 3771010
5-methyl-N-(3-methylbutyl)-3-phenylpyrazolo[1,5-a]pyrimidin-7-amine
CID 5183680

Frequently Asked Questions

What is the IUPAC name of 7-methyl-3-phenylpyrazolo[1,5-a]pyrimidin-5-amine?
The IUPAC name of 7-methyl-3-phenylpyrazolo[1,5-a]pyrimidin-5-amine (CID 105481983) is 7-methyl-3-phenylpyrazolo[1,5-a]pyrimidin-5-amine.
What is the SMILES notation for 7-methyl-3-phenylpyrazolo[1,5-a]pyrimidin-5-amine?
The canonical SMILES for 7-methyl-3-phenylpyrazolo[1,5-a]pyrimidin-5-amine is Cc1cc(N)nc2c(-c3ccccc3)cnn12.
What is the InChIKey of 7-methyl-3-phenylpyrazolo[1,5-a]pyrimidin-5-amine?
The InChIKey is ICPRFIJLZFJRTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12N4/c1-9-7-12(14)16-13-11(8-15-17(9)13)10-5-3-2-4-6-10/h2-8H,1H3,(H2,14,16).
What are the key properties of 7-methyl-3-phenylpyrazolo[1,5-a]pyrimidin-5-amine?
7-methyl-3-phenylpyrazolo[1,5-a]pyrimidin-5-amine has a molecular weight of 224.27 g/mol, XLogP of 2.29, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-3-phenylpyrazolo[1,5-a]pyrimidin-5-amine is sourced from PubChem (CID 105481983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).