1-[2-(4-methoxyphenyl)-5-phenylpyrazolo[1,5-a]pyrimidin-7-yl]piperidin-4-ol

C24H24N4O2 — CID 1441477

IUPAC1-[2-(4-methoxyphenyl)-5-phenylpyrazolo[1,5-a]pyrimidin-7-yl]piperidin-4-ol
SMILESCOc1ccc(-c2cc3nc(-c4ccccc4)cc(N4CCC(O)CC4)n3n2)cc1
InChIInChI=1S/C24H24N4O2/c1-30-20-9-7-18(8-10-20)22-15-23-25-21(17-5-3-2-4-6-17)16-24(28(23)26-22)27-13-11-19(29)12-14-27/h2-10,15-16,19,29H,11-14H2,1H3
InChIKeyXYOBVUFBQUSQMO-UHFFFAOYSA-N
MW400.48 g/mol
LogP4.03
Rot. Bonds4

About 1-[2-(4-methoxyphenyl)-5-phenylpyrazolo[1,5-a]pyrimidin-7-yl]piperidin-4-ol

1-[2-(4-methoxyphenyl)-5-phenylpyrazolo[1,5-a]pyrimidin-7-yl]piperidin-4-ol (PubChem CID 1441477) has the molecular formula C24H24N4O2 and a molecular weight of 400.48 g/mol. Its IUPAC name is 1-[2-(4-methoxyphenyl)-5-phenylpyrazolo[1,5-a]pyrimidin-7-yl]piperidin-4-ol.

Molecular Properties

Compound Name1-[2-(4-methoxyphenyl)-5-phenylpyrazolo[1,5-a]pyrimidin-7-yl]piperidin-4-ol
PubChem CID1441477
Molecular FormulaC24H24N4O2
Molecular Weight400.48 g/mol
Exact Mass400.19
IUPAC Name1-[2-(4-methoxyphenyl)-5-phenylpyrazolo[1,5-a]pyrimidin-7-yl]piperidin-4-ol
SMILESCOc1ccc(-c2cc3nc(-c4ccccc4)cc(N4CCC(O)CC4)n3n2)cc1
InChIInChI=1S/C24H24N4O2/c1-30-20-9-7-18(8-10-20)22-15-23-25-21(17-5-3-2-4-6-17)16-24(28(23)26-22)27-13-11-19(29)12-14-27/h2-10,15-16,19,29H,11-14H2,1H3
InChIKeyXYOBVUFBQUSQMO-UHFFFAOYSA-N
XLogP4.03
TPSA62.89 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500400.48
LogP ≤ 54.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

Pexacerfont
CID 9884366
N,N-diethyl-2-(2-(4-(2-fluoroethoxy)phenyl)-5,7-dimethylpyrazolo(1,5-a)pyrimidin-3-yl)acetamide
CID 24895172
Bms-561388
CID 9908904
5-(4-Methoxyphenyl)-N-(4-(4-methylpiperazin-1-yl)phenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine
CID 44556112
2-Propanol, 1-((3-(4-methoxyphenyl)-1,2,4-triazolo(3,4-a)phthalazin-6-yl)methylamino)-
CID 3071187
N,N-Diethyl-(2-(4-(2-(18F)fluoroethoxy)phenyl)-5,7-dimethylpyrazolo(1,5-A)pyrimidine-3-YL)acetamide
CID 23582365
6-(4-Methoxyphenyl)-3-pyridin-4-ylpyrazolo[1,5-a]pyrimidine
CID 5329457
6-(4-Methoxyphenyl)-3-(pyridin-3-yl)pyrazolo[1,5-a]pyrimidine
CID 5329458
N,N-Diethyl-2-(2-(4-methoxyphenyl)-5,7-dimethylpyrazolo(1,5-a)pyrimidin-3-yl)acetamide
CID 11595759
Methyl substituted pyrazole, 28
CID 23648676
Pyrazolo[1,5-a]-1,3,5-triazin-4-amine,8-(6-methoxy-2-methyl-3-pyridinyl)-2,7-dimethyl-N-[(1S)-1-methylpropyl]-
CID 42618221
N,N-Dimethyl-3-(4-(3-(4-quinolinyl)pyrazolo(1,5-a)pyrimidin-6-yl)phenoxy)-1-propanamine
CID 50997749

Frequently Asked Questions

What is the IUPAC name of 1-[2-(4-methoxyphenyl)-5-phenylpyrazolo[1,5-a]pyrimidin-7-yl]piperidin-4-ol?
The IUPAC name of 1-[2-(4-methoxyphenyl)-5-phenylpyrazolo[1,5-a]pyrimidin-7-yl]piperidin-4-ol (CID 1441477) is 1-[2-(4-methoxyphenyl)-5-phenylpyrazolo[1,5-a]pyrimidin-7-yl]piperidin-4-ol.
What is the SMILES notation for 1-[2-(4-methoxyphenyl)-5-phenylpyrazolo[1,5-a]pyrimidin-7-yl]piperidin-4-ol?
The canonical SMILES for 1-[2-(4-methoxyphenyl)-5-phenylpyrazolo[1,5-a]pyrimidin-7-yl]piperidin-4-ol is COc1ccc(-c2cc3nc(-c4ccccc4)cc(N4CCC(O)CC4)n3n2)cc1.
What is the InChIKey of 1-[2-(4-methoxyphenyl)-5-phenylpyrazolo[1,5-a]pyrimidin-7-yl]piperidin-4-ol?
The InChIKey is XYOBVUFBQUSQMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N4O2/c1-30-20-9-7-18(8-10-20)22-15-23-25-21(17-5-3-2-4-6-17)16-24(28(23)26-22)27-13-11-19(29)12-14-27/h2-10,15-16,19,29H,11-14H2,1H3.
What are the key properties of 1-[2-(4-methoxyphenyl)-5-phenylpyrazolo[1,5-a]pyrimidin-7-yl]piperidin-4-ol?
1-[2-(4-methoxyphenyl)-5-phenylpyrazolo[1,5-a]pyrimidin-7-yl]piperidin-4-ol has a molecular weight of 400.48 g/mol, XLogP of 4.03, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(4-methoxyphenyl)-5-phenylpyrazolo[1,5-a]pyrimidin-7-yl]piperidin-4-ol is sourced from PubChem (CID 1441477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).