1-cyclopentyl-6-[(2-ethoxyphenyl)methyl]-5H-pyrazolo[5,4-d]pyrimidin-4-one;1-cyclopentyl-6-[(2-methoxyphenyl)methyl]-5H-pyrazolo[5,4-d]pyrimidin-4-one;6-(cyclopropylmethyl)-1-(oxolan-3-yl)-5H-pyrazolo[5,4-d]pyrimidin-4-one;6-(2-ethylbutyl)-1-(oxolan-3-yl)-5H-pyrazolo[5,4-d]pyrimidin-4-one;1-(oxolan-3-yl)-6-(oxolan-3-ylmethyl)-5H-pyrazolo[5,4-d]pyrimidin-4-one;1-(oxolan-3-yl)-6-(pyridin-3-ylmethyl)-5H-pyrazolo[5,4-d]pyrimidin-4-one;1-(oxolan-3-yl)-6-[2-(trifluoromethyl)butyl]-5H-pyrazolo[5,4-d]pyrimidin-4-one

C108H130F3N29O15 — CID 159499634

About 1-cyclopentyl-6-[(2-ethoxyphenyl)methyl]-5H-pyrazolo[5,4-d]pyrimidin-4-one;1-cyclopentyl-6-[(2-methoxyphenyl)methyl]-5H-pyrazolo[5,4-d]pyrimidin-4-one;6-(cyclopropylmethyl)-1-(oxolan-3-yl)-5H-pyrazolo[5,4-d]pyrimidin-4-one;6-(2-ethylbutyl)-1-(oxolan-3-yl)-5H-pyrazolo[5,4-d]pyrimidin-4-one;1-(oxolan-3-yl)-6-(oxolan-3-ylmethyl)-5H-pyrazolo[5,4-d]pyrimidin-4-one;1-(oxolan-3-yl)-6-(pyridin-3-ylmethyl)-5H-pyrazolo[5,4-d]pyrimidin-4-one;1-(oxolan-3-yl)-6-[2-(trifluoromethyl)butyl]-5H-pyrazolo[5,4-d]pyrimidin-4-one

1-cyclopentyl-6-[(2-ethoxyphenyl)methyl]-5H-pyrazolo[5,4-d]pyrimidin-4-one;1-cyclopentyl-6-[(2-methoxyphenyl)methyl]-5H-pyrazolo[5,4-d]pyrimidin-4-one;6-(cyclopropylmethyl)-1-(oxolan-3-yl)-5H-pyrazolo[5,4-d]pyrimidin-4-one;6-(2-ethylbutyl)-1-(oxolan-3-yl)-5H-pyrazolo[5,4-d]pyrimidin-4-one;1-(oxolan-3-yl)-6-(oxolan-3-ylmethyl)-5H-pyrazolo[5,4-d]pyrimidin-4-one;1-(oxolan-3-yl)-6-(pyridin-3-ylmethyl)-5H-pyrazolo[5,4-d]pyrimidin-4-one;1-(oxolan-3-yl)-6-[2-(trifluoromethyl)butyl]-5H-pyrazolo[5,4-d]pyrimidin-4-one (PubChem CID 159499634) has the molecular formula C108H130F3N29O15 and a molecular weight of 2131.41 g/mol. Its IUPAC name is 1-cyclopentyl-6-[(2-ethoxyphenyl)methyl]-5H-pyrazolo[5,4-d]pyrimidin-4-one;1-cyclopentyl-6-[(2-methoxyphenyl)methyl]-5H-pyrazolo[5,4-d]pyrimidin-4-one;6-(cyclopropylmethyl)-1-(oxolan-3-yl)-5H-pyrazolo[5,4-d]pyrimidin-4-one;6-(2-ethylbutyl)-1-(oxolan-3-yl)-5H-pyrazolo[5,4-d]pyrimidin-4-one;1-(oxolan-3-yl)-6-(oxolan-3-ylmethyl)-5H-pyrazolo[5,4-d]pyrimidin-4-one;1-(oxolan-3-yl)-6-(pyridin-3-ylmethyl)-5H-pyrazolo[5,4-d]pyrimidin-4-one;1-(oxolan-3-yl)-6-[2-(trifluoromethyl)butyl]-5H-pyrazolo[5,4-d]pyrimidin-4-one.

Molecular Properties

• Compound Name: 1-cyclopentyl-6-[(2-ethoxyphenyl)methyl]-5H-pyrazolo[5,4-d]pyrimidin-4-one;1-cyclopentyl-6-[(2-methoxyphenyl)methyl]-5H-pyrazolo[5,4-d]pyrimidin-4-one;6-(cyclopropylmethyl)-1-(oxolan-3-yl)-5H-pyrazolo[5,4-d]pyrimidin-4-one;6-(2-ethylbutyl)-1-(oxolan-3-yl)-5H-pyrazolo[5,4-d]pyrimidin-4-one;1-(oxolan-3-yl)-6-(oxolan-3-ylmethyl)-5H-pyrazolo[5,4-d]pyrimidin-4-one;1-(oxolan-3-yl)-6-(pyridin-3-ylmethyl)-5H-pyrazolo[5,4-d]pyrimidin-4-one;1-(oxolan-3-yl)-6-[2-(trifluoromethyl)butyl]-5H-pyrazolo[5,4-d]pyrimidin-4-one
• PubChem CID: 159499634
• Molecular Formula: C108H130F3N29O15
• Molecular Weight: 2131.41 g/mol
• Exact Mass: 2130.03
• IUPAC Name: 1-cyclopentyl-6-[(2-ethoxyphenyl)methyl]-5H-pyrazolo[5,4-d]pyrimidin-4-one;1-cyclopentyl-6-[(2-methoxyphenyl)methyl]-5H-pyrazolo[5,4-d]pyrimidin-4-one;6-(cyclopropylmethyl)-1-(oxolan-3-yl)-5H-pyrazolo[5,4-d]pyrimidin-4-one;6-(2-ethylbutyl)-1-(oxolan-3-yl)-5H-pyrazolo[5,4-d]pyrimidin-4-one;1-(oxolan-3-yl)-6-(oxolan-3-ylmethyl)-5H-pyrazolo[5,4-d]pyrimidin-4-one;1-(oxolan-3-yl)-6-(pyridin-3-ylmethyl)-5H-pyrazolo[5,4-d]pyrimidin-4-one;1-(oxolan-3-yl)-6-[2-(trifluoromethyl)butyl]-5H-pyrazolo[5,4-d]pyrimidin-4-one
• SMILES: CCC(CC)Cc1nc2c(cnn2C2CCOC2)c(=O)[nH]1.CCC(Cc1nc2c(cnn2C2CCOC2)c(=O)[nH]1)C(F)(F)F.CCOc1ccccc1Cc1nc2c(cnn2C2CCCC2)c(=O)[nH]1.COc1ccccc1Cc1nc2c(cnn2C2CCCC2)c(=O)[nH]1.O=c1[nH]c(CC2CC2)nc2c1cnn2C1CCOC1.O=c1[nH]c(CC2CCOC2)nc2c1cnn2C1CCOC1.O=c1[nH]c(Cc2cccnc2)nc2c1cnn2C1CCOC1
• InChI: InChI=1S/C19H22N4O2.C18H20N4O2.C15H15N5O2.C15H22N4O2.C14H17F3N4O2.C14H18N4O3.C13H16N4O2/c1-2-25-16-10-6-3-7-13(16)11-17-21-18-15(19(24)22-17)12-20-23(18)14-8-4-5-9-14;1-24-15-9-5-2-6-12(15)10-16-20-17-14(18(23)21-16)11-19-22(17)13-7-3-4-8-13;21-15-12-8-17-20(11-3-5-22-9-11)14(12)18-13(19-15)6-10-2-1-4-16-7-10;1-3-10(4-2)7-13-17-14-12(15(20)18-13)8-16-19(14)11-5-6-21-9-11;1-2-8(14(15,16)17)5-11-19-12-10(13(22)20-11)6-18-21(12)9-3-4-23-7-9;19-14-11-6-15-18(10-2-4-21-8-10)13(11)16-12(17-14)5-9-1-3-20-7-9;18-13-10-6-14-17(9-3-4-19-7-9)12(10)15-11(16-13)5-8-1-2-8/h3,6-7,10,12,14H,2,4-5,8-9,11H2,1H3,(H,21,22,24);2,5-6,9,11,13H,3-4,7-8,10H2,1H3,(H,20,21,23);1-2,4,7-8,11H,3,5-6,9H2,(H,18,19,21);8,10-11H,3-7,9H2,1-2H3,(H,17,18,20);6,8-9H,2-5,7H2,1H3,(H,19,20,22);6,9-10H,1-5,7-8H2,(H,16,17,19);6,8-9H,1-5,7H2,(H,15,16,18)
• InChIKey: LZFHVIZXIMDLSJ-UHFFFAOYSA-N
• XLogP: 13.09
• TPSA: 531.72 Ų
• H-Bond Donors: 7
• H-Bond Acceptors: 37
• Rotatable Bonds: 27
• Heavy Atoms: 155
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2131.41
LogP ≤ 5	13.09
H-Bond Donors ≤ 5	7
H-Bond Acceptors ≤ 10	37

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-6-[(2-ethoxyphenyl)methyl]-5H-pyrazolo[5,4-d]pyrimidin-4-one;1-cyclopentyl-6-[(2-methoxyphenyl)methyl]-5H-pyrazolo[5,4-d]pyrimidin-4-one;6-(cyclopropylmethyl)-1-(oxolan-3-yl)-5H-pyrazolo[5,4-d]pyrimidin-4-one;6-(2-ethylbutyl)-1-(oxolan-3-yl)-5H-pyrazolo[5,4-d]pyrimidin-4-one;1-(oxolan-3-yl)-6-(oxolan-3-ylmethyl)-5H-pyrazolo[5,4-d]pyrimidin-4-one;1-(oxolan-3-yl)-6-(pyridin-3-ylmethyl)-5H-pyrazolo[5,4-d]pyrimidin-4-one;1-(oxolan-3-yl)-6-[2-(trifluoromethyl)butyl]-5H-pyrazolo[5,4-d]pyrimidin-4-one?

The IUPAC name of 1-cyclopentyl-6-[(2-ethoxyphenyl)methyl]-5H-pyrazolo[5,4-d]pyrimidin-4-one;1-cyclopentyl-6-[(2-methoxyphenyl)methyl]-5H-pyrazolo[5,4-d]pyrimidin-4-one;6-(cyclopropylmethyl)-1-(oxolan-3-yl)-5H-pyrazolo[5,4-d]pyrimidin-4-one;6-(2-ethylbutyl)-1-(oxolan-3-yl)-5H-pyrazolo[5,4-d]pyrimidin-4-one;1-(oxolan-3-yl)-6-(oxolan-3-ylmethyl)-5H-pyrazolo[5,4-d]pyrimidin-4-one;1-(oxolan-3-yl)-6-(pyridin-3-ylmethyl)-5H-pyrazolo[5,4-d]pyrimidin-4-one;1-(oxolan-3-yl)-6-[2-(trifluoromethyl)butyl]-5H-pyrazolo[5,4-d]pyrimidin-4-one (CID 159499634) is 1-cyclopentyl-6-[(2-ethoxyphenyl)methyl]-5H-pyrazolo[5,4-d]pyrimidin-4-one;1-cyclopentyl-6-[(2-methoxyphenyl)methyl]-5H-pyrazolo[5,4-d]pyrimidin-4-one;6-(cyclopropylmethyl)-1-(oxolan-3-yl)-5H-pyrazolo[5,4-d]pyrimidin-4-one;6-(2-ethylbutyl)-1-(oxolan-3-yl)-5H-pyrazolo[5,4-d]pyrimidin-4-one;1-(oxolan-3-yl)-6-(oxolan-3-ylmethyl)-5H-pyrazolo[5,4-d]pyrimidin-4-one;1-(oxolan-3-yl)-6-(pyridin-3-ylmethyl)-5H-pyrazolo[5,4-d]pyrimidin-4-one;1-(oxolan-3-yl)-6-[2-(trifluoromethyl)butyl]-5H-pyrazolo[5,4-d]pyrimidin-4-one.

What is the SMILES notation for 1-cyclopentyl-6-[(2-ethoxyphenyl)methyl]-5H-pyrazolo[5,4-d]pyrimidin-4-one;1-cyclopentyl-6-[(2-methoxyphenyl)methyl]-5H-pyrazolo[5,4-d]pyrimidin-4-one;6-(cyclopropylmethyl)-1-(oxolan-3-yl)-5H-pyrazolo[5,4-d]pyrimidin-4-one;6-(2-ethylbutyl)-1-(oxolan-3-yl)-5H-pyrazolo[5,4-d]pyrimidin-4-one;1-(oxolan-3-yl)-6-(oxolan-3-ylmethyl)-5H-pyrazolo[5,4-d]pyrimidin-4-one;1-(oxolan-3-yl)-6-(pyridin-3-ylmethyl)-5H-pyrazolo[5,4-d]pyrimidin-4-one;1-(oxolan-3-yl)-6-[2-(trifluoromethyl)butyl]-5H-pyrazolo[5,4-d]pyrimidin-4-one?

The canonical SMILES for 1-cyclopentyl-6-[(2-ethoxyphenyl)methyl]-5H-pyrazolo[5,4-d]pyrimidin-4-one;1-cyclopentyl-6-[(2-methoxyphenyl)methyl]-5H-pyrazolo[5,4-d]pyrimidin-4-one;6-(cyclopropylmethyl)-1-(oxolan-3-yl)-5H-pyrazolo[5,4-d]pyrimidin-4-one;6-(2-ethylbutyl)-1-(oxolan-3-yl)-5H-pyrazolo[5,4-d]pyrimidin-4-one;1-(oxolan-3-yl)-6-(oxolan-3-ylmethyl)-5H-pyrazolo[5,4-d]pyrimidin-4-one;1-(oxolan-3-yl)-6-(pyridin-3-ylmethyl)-5H-pyrazolo[5,4-d]pyrimidin-4-one;1-(oxolan-3-yl)-6-[2-(trifluoromethyl)butyl]-5H-pyrazolo[5,4-d]pyrimidin-4-one is CCC(CC)Cc1nc2c(cnn2C2CCOC2)c(=O)[nH]1.CCC(Cc1nc2c(cnn2C2CCOC2)c(=O)[nH]1)C(F)(F)F.CCOc1ccccc1Cc1nc2c(cnn2C2CCCC2)c(=O)[nH]1.COc1ccccc1Cc1nc2c(cnn2C2CCCC2)c(=O)[nH]1.O=c1[nH]c(CC2CC2)nc2c1cnn2C1CCOC1.O=c1[nH]c(CC2CCOC2)nc2c1cnn2C1CCOC1.O=c1[nH]c(Cc2cccnc2)nc2c1cnn2C1CCOC1.

What is the InChIKey of 1-cyclopentyl-6-[(2-ethoxyphenyl)methyl]-5H-pyrazolo[5,4-d]pyrimidin-4-one;1-cyclopentyl-6-[(2-methoxyphenyl)methyl]-5H-pyrazolo[5,4-d]pyrimidin-4-one;6-(cyclopropylmethyl)-1-(oxolan-3-yl)-5H-pyrazolo[5,4-d]pyrimidin-4-one;6-(2-ethylbutyl)-1-(oxolan-3-yl)-5H-pyrazolo[5,4-d]pyrimidin-4-one;1-(oxolan-3-yl)-6-(oxolan-3-ylmethyl)-5H-pyrazolo[5,4-d]pyrimidin-4-one;1-(oxolan-3-yl)-6-(pyridin-3-ylmethyl)-5H-pyrazolo[5,4-d]pyrimidin-4-one;1-(oxolan-3-yl)-6-[2-(trifluoromethyl)butyl]-5H-pyrazolo[5,4-d]pyrimidin-4-one?

The InChIKey is LZFHVIZXIMDLSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N4O2.C18H20N4O2.C15H15N5O2.C15H22N4O2.C14H17F3N4O2.C14H18N4O3.C13H16N4O2/c1-2-25-16-10-6-3-7-13(16)11-17-21-18-15(19(24)22-17)12-20-23(18)14-8-4-5-9-14;1-24-15-9-5-2-6-12(15)10-16-20-17-14(18(23)21-16)11-19-22(17)13-7-3-4-8-13;21-15-12-8-17-20(11-3-5-22-9-11)14(12)18-13(19-15)6-10-2-1-4-16-7-10;1-3-10(4-2)7-13-17-14-12(15(20)18-13)8-16-19(14)11-5-6-21-9-11;1-2-8(14(15,16)17)5-11-19-12-10(13(22)20-11)6-18-21(12)9-3-4-23-7-9;19-14-11-6-15-18(10-2-4-21-8-10)13(11)16-12(17-14)5-9-1-3-20-7-9;18-13-10-6-14-17(9-3-4-19-7-9)12(10)15-11(16-13)5-8-1-2-8/h3,6-7,10,12,14H,2,4-5,8-9,11H2,1H3,(H,21,22,24);2,5-6,9,11,13H,3-4,7-8,10H2,1H3,(H,20,21,23);1-2,4,7-8,11H,3,5-6,9H2,(H,18,19,21);8,10-11H,3-7,9H2,1-2H3,(H,17,18,20);6,8-9H,2-5,7H2,1H3,(H,19,20,22);6,9-10H,1-5,7-8H2,(H,16,17,19);6,8-9H,1-5,7H2,(H,15,16,18).

What are the key properties of 1-cyclopentyl-6-[(2-ethoxyphenyl)methyl]-5H-pyrazolo[5,4-d]pyrimidin-4-one;1-cyclopentyl-6-[(2-methoxyphenyl)methyl]-5H-pyrazolo[5,4-d]pyrimidin-4-one;6-(cyclopropylmethyl)-1-(oxolan-3-yl)-5H-pyrazolo[5,4-d]pyrimidin-4-one;6-(2-ethylbutyl)-1-(oxolan-3-yl)-5H-pyrazolo[5,4-d]pyrimidin-4-one;1-(oxolan-3-yl)-6-(oxolan-3-ylmethyl)-5H-pyrazolo[5,4-d]pyrimidin-4-one;1-(oxolan-3-yl)-6-(pyridin-3-ylmethyl)-5H-pyrazolo[5,4-d]pyrimidin-4-one;1-(oxolan-3-yl)-6-[2-(trifluoromethyl)butyl]-5H-pyrazolo[5,4-d]pyrimidin-4-one?

1-cyclopentyl-6-[(2-ethoxyphenyl)methyl]-5H-pyrazolo[5,4-d]pyrimidin-4-one;1-cyclopentyl-6-[(2-methoxyphenyl)methyl]-5H-pyrazolo[5,4-d]pyrimidin-4-one;6-(cyclopropylmethyl)-1-(oxolan-3-yl)-5H-pyrazolo[5,4-d]pyrimidin-4-one;6-(2-ethylbutyl)-1-(oxolan-3-yl)-5H-pyrazolo[5,4-d]pyrimidin-4-one;1-(oxolan-3-yl)-6-(oxolan-3-ylmethyl)-5H-pyrazolo[5,4-d]pyrimidin-4-one;1-(oxolan-3-yl)-6-(pyridin-3-ylmethyl)-5H-pyrazolo[5,4-d]pyrimidin-4-one;1-(oxolan-3-yl)-6-[2-(trifluoromethyl)butyl]-5H-pyrazolo[5,4-d]pyrimidin-4-one has a molecular weight of 2131.41 g/mol, XLogP of 13.09, 27 rotatable bonds, 7 hydrogen bond donors, and 37 hydrogen bond acceptors.

Where does this data come from?

All data for 1-cyclopentyl-6-[(2-ethoxyphenyl)methyl]-5H-pyrazolo[5,4-d]pyrimidin-4-one;1-cyclopentyl-6-[(2-methoxyphenyl)methyl]-5H-pyrazolo[5,4-d]pyrimidin-4-one;6-(cyclopropylmethyl)-1-(oxolan-3-yl)-5H-pyrazolo[5,4-d]pyrimidin-4-one;6-(2-ethylbutyl)-1-(oxolan-3-yl)-5H-pyrazolo[5,4-d]pyrimidin-4-one;1-(oxolan-3-yl)-6-(oxolan-3-ylmethyl)-5H-pyrazolo[5,4-d]pyrimidin-4-one;1-(oxolan-3-yl)-6-(pyridin-3-ylmethyl)-5H-pyrazolo[5,4-d]pyrimidin-4-one;1-(oxolan-3-yl)-6-[2-(trifluoromethyl)butyl]-5H-pyrazolo[5,4-d]pyrimidin-4-one is sourced from PubChem (CID 159499634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).