7-(2-methylimidazol-1-yl)-3-phenyl-5-propylpyrazolo[1,5-a]pyrimidine

C19H19N5 — CID 4909998

IUPAC7-(2-methylimidazol-1-yl)-3-phenyl-5-propylpyrazolo[1,5-a]pyrimidine
SMILESCCCc1cc(-n2ccnc2C)n2ncc(-c3ccccc3)c2n1
InChIInChI=1S/C19H19N5/c1-3-7-16-12-18(23-11-10-20-14(23)2)24-19(22-16)17(13-21-24)15-8-5-4-6-9-15/h4-6,8-13H,3,7H2,1-2H3
InChIKeyVMUYEVCUSJYCBI-UHFFFAOYSA-N
MW317.40 g/mol
LogP3.84
Rot. Bonds4

About 7-(2-methylimidazol-1-yl)-3-phenyl-5-propylpyrazolo[1,5-a]pyrimidine

7-(2-methylimidazol-1-yl)-3-phenyl-5-propylpyrazolo[1,5-a]pyrimidine (PubChem CID 4909998) has the molecular formula C19H19N5 and a molecular weight of 317.40 g/mol. Its IUPAC name is 7-(2-methylimidazol-1-yl)-3-phenyl-5-propylpyrazolo[1,5-a]pyrimidine.

Molecular Properties

Compound Name7-(2-methylimidazol-1-yl)-3-phenyl-5-propylpyrazolo[1,5-a]pyrimidine
PubChem CID4909998
Molecular FormulaC19H19N5
Molecular Weight317.40 g/mol
Exact Mass317.16
IUPAC Name7-(2-methylimidazol-1-yl)-3-phenyl-5-propylpyrazolo[1,5-a]pyrimidine
SMILESCCCc1cc(-n2ccnc2C)n2ncc(-c3ccccc3)c2n1
InChIInChI=1S/C19H19N5/c1-3-7-16-12-18(23-11-10-20-14(23)2)24-19(22-16)17(13-21-24)15-8-5-4-6-9-15/h4-6,8-13H,3,7H2,1-2H3
InChIKeyVMUYEVCUSJYCBI-UHFFFAOYSA-N
XLogP3.84
TPSA48.01 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.40
LogP ≤ 53.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

7-(azepan-1-yl)-3-(4-fluorophenyl)-5-propylpyrazolo[1,5-a]pyrimidine
CID 166626976
7-(benzimidazol-1-yl)-5-methyl-3-phenylpyrazolo[1,5-a]pyrimidine
CID 3817354
N-(3-morpholin-4-ium-4-ylpropyl)-3-phenyl-5-propylpyrazolo[1,5-a]pyrimidin-7-amine
CID 7632078
5-methyl-N-pentyl-3-phenylpyrazolo[1,5-a]pyrimidin-7-amine
CID 3746157
7-methyl-3-phenylpyrazolo[1,5-a]pyrimidin-5-amine
CID 105481983
7-(4-benzylpiperidin-1-yl)-5-methyl-3-phenylpyrazolo[1,5-a]pyrimidine
CID 3615753
4-phenyl-2-propylquinoline
CID 145370518
2-ethyl-4,7-diphenyl-9-propyl-1,10-phenanthroline
CID 142200622
5,6-dimethyl-3-phenyl-7-piperidin-1-ylpyrazolo[1,5-a]pyrimidine
CID 8741392
N-(4-butylphenyl)-3-(4-chlorophenyl)-5-phenylpyrazolo[1,5-a]pyrimidin-7-amine
CID 4893914
4,7-diphenyl-2-propyl-1,10-phenanthroline
CID 123268572
7-(4-benzylpiperazin-1-yl)-5-methyl-3-(4-methylphenyl)pyrazolo[1,5-a]pyrimidine
CID 8741379

Frequently Asked Questions

What is the IUPAC name of 7-(2-methylimidazol-1-yl)-3-phenyl-5-propylpyrazolo[1,5-a]pyrimidine?
The IUPAC name of 7-(2-methylimidazol-1-yl)-3-phenyl-5-propylpyrazolo[1,5-a]pyrimidine (CID 4909998) is 7-(2-methylimidazol-1-yl)-3-phenyl-5-propylpyrazolo[1,5-a]pyrimidine.
What is the SMILES notation for 7-(2-methylimidazol-1-yl)-3-phenyl-5-propylpyrazolo[1,5-a]pyrimidine?
The canonical SMILES for 7-(2-methylimidazol-1-yl)-3-phenyl-5-propylpyrazolo[1,5-a]pyrimidine is CCCc1cc(-n2ccnc2C)n2ncc(-c3ccccc3)c2n1.
What is the InChIKey of 7-(2-methylimidazol-1-yl)-3-phenyl-5-propylpyrazolo[1,5-a]pyrimidine?
The InChIKey is VMUYEVCUSJYCBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N5/c1-3-7-16-12-18(23-11-10-20-14(23)2)24-19(22-16)17(13-21-24)15-8-5-4-6-9-15/h4-6,8-13H,3,7H2,1-2H3.
What are the key properties of 7-(2-methylimidazol-1-yl)-3-phenyl-5-propylpyrazolo[1,5-a]pyrimidine?
7-(2-methylimidazol-1-yl)-3-phenyl-5-propylpyrazolo[1,5-a]pyrimidine has a molecular weight of 317.40 g/mol, XLogP of 3.84, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(2-methylimidazol-1-yl)-3-phenyl-5-propylpyrazolo[1,5-a]pyrimidine is sourced from PubChem (CID 4909998), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).