[4-(dimethylamino)phenyl]-[7-(furan-2-yl)pyrazolo[1,5-a]pyrimidin-3-yl]methanone;furan-2-yl-[7-(furan-2-yl)pyrazolo[1,5-a]pyrimidin-3-yl]methanone;[7-(furan-2-yl)pyrazolo[1,5-a]pyrimidin-3-yl]-pyridin-2-ylmethanone;[7-(furan-2-yl)pyrazolo[1,5-a]pyrimidin-3-yl]-pyridin-3-ylmethanone;[7-(furan-2-yl)pyrazolo[1,5-a]pyrimidin-3-yl]-pyridin-4-ylmethanone;furan-2-yl-(7-thiophen-2-ylpyrazolo[1,5-a]pyrimidin-3-yl)methanone;pyridin-3-yl-(7-thiophen-2-ylpyrazolo[1,5-a]pyrimidin-3-yl)methanone;thiophen-2-yl-(7-thiophen-2-ylpyrazolo[1,5-a]pyrimidin-3-yl)methanone

C128H83N29O15S4 — CID 173417465

IUPAC[4-(dimethylamino)phenyl]-[7-(furan-2-yl)pyrazolo[1,5-a]pyrimidin-3-yl]methanone;furan-2-yl-[7-(furan-2-yl)pyrazolo[1,5-a]pyrimidin-3-yl]methanone;[7-(furan-2-yl)pyrazolo[1,5-a]pyrimidin-3-yl]-pyridin-2-ylmethanone;[7-(furan-2-yl)pyrazolo[1,5-a]pyrimidin-3-yl]-pyridin-3-ylmethanone;[7-(furan-2-yl)pyrazolo[1,5-a]pyrimidin-3-yl]-pyridin-4-ylmethanone;furan-2-yl-(7-thiophen-2-ylpyrazolo[1,5-a]pyrimidin-3-yl)methanone;pyridin-3-yl-(7-thiophen-2-ylpyrazolo[1,5-a]pyrimidin-3-yl)methanone;thiophen-2-yl-(7-thiophen-2-ylpyrazolo[1,5-a]pyrimidin-3-yl)methanone
SMILESCN(C)c1ccc(C(=O)c2cnn3c(-c4ccco4)ccnc23)cc1.O=C(c1ccccn1)c1cnn2c(-c3ccco3)ccnc12.O=C(c1cccnc1)c1cnn2c(-c3ccco3)ccnc12.O=C(c1cccnc1)c1cnn2c(-c3cccs3)ccnc12.O=C(c1ccco1)c1cnn2c(-c3ccco3)ccnc12.O=C(c1ccco1)c1cnn2c(-c3cccs3)ccnc12.O=C(c1cccs1)c1cnn2c(-c3cccs3)ccnc12.O=C(c1ccncc1)c1cnn2c(-c3ccco3)ccnc12
InChIInChI=1S/C19H16N4O2.3C16H10N4O2.C16H10N4OS.C15H9N3O3.C15H9N3O2S.C15H9N3OS2/c1-22(2)14-7-5-13(6-8-14)18(24)15-12-21-23-16(9-10-20-19(15)23)17-4-3-11-25-17;21-15(11-3-1-6-17-9-11)12-10-19-20-13(5-7-18-16(12)20)14-4-2-8-22-14;21-15(11-3-6-17-7-4-11)12-10-19-20-13(5-8-18-16(12)20)14-2-1-9-22-14;21-15(12-4-1-2-7-17-12)11-10-19-20-13(6-8-18-16(11)20)14-5-3-9-22-14;21-15(11-3-1-6-17-9-11)12-10-19-20-13(5-7-18-16(12)20)14-4-2-8-22-14;19-14(13-4-2-8-21-13)10-9-17-18-11(5-6-16-15(10)18)12-3-1-7-20-12;19-14(12-3-1-7-20-12)10-9-17-18-11(5-6-16-15(10)18)13-4-2-8-21-13;19-14(13-4-2-8-21-13)10-9-17-18-11(5-6-16-15(10)18)12-3-1-7-20-12/h3-12H,1-2H3;4*1-10H;3*1-9H
InChIKeyXYJKTEFHIUKBDS-UHFFFAOYSA-N
MW2395.53 g/mol
LogP24.06
Rot. Bonds25

About [4-(dimethylamino)phenyl]-[7-(furan-2-yl)pyrazolo[1,5-a]pyrimidin-3-yl]methanone;furan-2-yl-[7-(furan-2-yl)pyrazolo[1,5-a]pyrimidin-3-yl]methanone;[7-(furan-2-yl)pyrazolo[1,5-a]pyrimidin-3-yl]-pyridin-2-ylmethanone;[7-(furan-2-yl)pyrazolo[1,5-a]pyrimidin-3-yl]-pyridin-3-ylmethanone;[7-(furan-2-yl)pyrazolo[1,5-a]pyrimidin-3-yl]-pyridin-4-ylmethanone;furan-2-yl-(7-thiophen-2-ylpyrazolo[1,5-a]pyrimidin-3-yl)methanone;pyridin-3-yl-(7-thiophen-2-ylpyrazolo[1,5-a]pyrimidin-3-yl)methanone;thiophen-2-yl-(7-thiophen-2-ylpyrazolo[1,5-a]pyrimidin-3-yl)methanone

[4-(dimethylamino)phenyl]-[7-(furan-2-yl)pyrazolo[1,5-a]pyrimidin-3-yl]methanone;furan-2-yl-[7-(furan-2-yl)pyrazolo[1,5-a]pyrimidin-3-yl]methanone;[7-(furan-2-yl)pyrazolo[1,5-a]pyrimidin-3-yl]-pyridin-2-ylmethanone;[7-(furan-2-yl)pyrazolo[1,5-a]pyrimidin-3-yl]-pyridin-3-ylmethanone;[7-(furan-2-yl)pyrazolo[1,5-a]pyrimidin-3-yl]-pyridin-4-ylmethanone;furan-2-yl-(7-thiophen-2-ylpyrazolo[1,5-a]pyrimidin-3-yl)methanone;pyridin-3-yl-(7-thiophen-2-ylpyrazolo[1,5-a]pyrimidin-3-yl)methanone;thiophen-2-yl-(7-thiophen-2-ylpyrazolo[1,5-a]pyrimidin-3-yl)methanone (PubChem CID 173417465) has the molecular formula C128H83N29O15S4 and a molecular weight of 2395.53 g/mol. Its IUPAC name is [4-(dimethylamino)phenyl]-[7-(furan-2-yl)pyrazolo[1,5-a]pyrimidin-3-yl]methanone;furan-2-yl-[7-(furan-2-yl)pyrazolo[1,5-a]pyrimidin-3-yl]methanone;[7-(furan-2-yl)pyrazolo[1,5-a]pyrimidin-3-yl]-pyridin-2-ylmethanone;[7-(furan-2-yl)pyrazolo[1,5-a]pyrimidin-3-yl]-pyridin-3-ylmethanone;[7-(furan-2-yl)pyrazolo[1,5-a]pyrimidin-3-yl]-pyridin-4-ylmethanone;furan-2-yl-(7-thiophen-2-ylpyrazolo[1,5-a]pyrimidin-3-yl)methanone;pyridin-3-yl-(7-thiophen-2-ylpyrazolo[1,5-a]pyrimidin-3-yl)methanone;thiophen-2-yl-(7-thiophen-2-ylpyrazolo[1,5-a]pyrimidin-3-yl)methanone.

Molecular Properties

Compound Name[4-(dimethylamino)phenyl]-[7-(furan-2-yl)pyrazolo[1,5-a]pyrimidin-3-yl]methanone;furan-2-yl-[7-(furan-2-yl)pyrazolo[1,5-a]pyrimidin-3-yl]methanone;[7-(furan-2-yl)pyrazolo[1,5-a]pyrimidin-3-yl]-pyridin-2-ylmethanone;[7-(furan-2-yl)pyrazolo[1,5-a]pyrimidin-3-yl]-pyridin-3-ylmethanone;[7-(furan-2-yl)pyrazolo[1,5-a]pyrimidin-3-yl]-pyridin-4-ylmethanone;furan-2-yl-(7-thiophen-2-ylpyrazolo[1,5-a]pyrimidin-3-yl)methanone;pyridin-3-yl-(7-thiophen-2-ylpyrazolo[1,5-a]pyrimidin-3-yl)methanone;thiophen-2-yl-(7-thiophen-2-ylpyrazolo[1,5-a]pyrimidin-3-yl)methanone
PubChem CID173417465
Molecular FormulaC128H83N29O15S4
Molecular Weight2395.53 g/mol
Exact Mass2393.55
IUPAC Name[4-(dimethylamino)phenyl]-[7-(furan-2-yl)pyrazolo[1,5-a]pyrimidin-3-yl]methanone;furan-2-yl-[7-(furan-2-yl)pyrazolo[1,5-a]pyrimidin-3-yl]methanone;[7-(furan-2-yl)pyrazolo[1,5-a]pyrimidin-3-yl]-pyridin-2-ylmethanone;[7-(furan-2-yl)pyrazolo[1,5-a]pyrimidin-3-yl]-pyridin-3-ylmethanone;[7-(furan-2-yl)pyrazolo[1,5-a]pyrimidin-3-yl]-pyridin-4-ylmethanone;furan-2-yl-(7-thiophen-2-ylpyrazolo[1,5-a]pyrimidin-3-yl)methanone;pyridin-3-yl-(7-thiophen-2-ylpyrazolo[1,5-a]pyrimidin-3-yl)methanone;thiophen-2-yl-(7-thiophen-2-ylpyrazolo[1,5-a]pyrimidin-3-yl)methanone
SMILESCN(C)c1ccc(C(=O)c2cnn3c(-c4ccco4)ccnc23)cc1.O=C(c1ccccn1)c1cnn2c(-c3ccco3)ccnc12.O=C(c1cccnc1)c1cnn2c(-c3ccco3)ccnc12.O=C(c1cccnc1)c1cnn2c(-c3cccs3)ccnc12.O=C(c1ccco1)c1cnn2c(-c3ccco3)ccnc12.O=C(c1ccco1)c1cnn2c(-c3cccs3)ccnc12.O=C(c1cccs1)c1cnn2c(-c3cccs3)ccnc12.O=C(c1ccncc1)c1cnn2c(-c3ccco3)ccnc12
InChIInChI=1S/C19H16N4O2.3C16H10N4O2.C16H10N4OS.C15H9N3O3.C15H9N3O2S.C15H9N3OS2/c1-22(2)14-7-5-13(6-8-14)18(24)15-12-21-23-16(9-10-20-19(15)23)17-4-3-11-25-17;21-15(11-3-1-6-17-9-11)12-10-19-20-13(5-7-18-16(12)20)14-4-2-8-22-14;21-15(11-3-6-17-7-4-11)12-10-19-20-13(5-8-18-16(12)20)14-2-1-9-22-14;21-15(12-4-1-2-7-17-12)11-10-19-20-13(6-8-18-16(11)20)14-5-3-9-22-14;21-15(11-3-1-6-17-9-11)12-10-19-20-13(5-7-18-16(12)20)14-4-2-8-22-14;19-14(13-4-2-8-21-13)10-9-17-18-11(5-6-16-15(10)18)12-3-1-7-20-12;19-14(12-3-1-7-20-12)10-9-17-18-11(5-6-16-15(10)18)13-4-2-8-21-13;19-14(13-4-2-8-21-13)10-9-17-18-11(5-6-16-15(10)18)12-3-1-7-20-12/h3-12H,1-2H3;4*1-10H;3*1-9H
InChIKeyXYJKTEFHIUKBDS-UHFFFAOYSA-N
XLogP24.06
TPSA524.86 Ų
H-Bond Donors
H-Bond Acceptors48
Rotatable Bonds25
Heavy Atoms176
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002395.53
LogP ≤ 524.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1048

Analyze [4-(dimethylamino)phenyl]-[7-(furan-2-yl)pyrazolo[1,5-a]pyrimidin-3-yl]methanone;furan-2-yl-[7-(furan-2-yl)pyrazolo[1,5-a]pyrimidin-3-yl]methanone;[7-(furan-2-yl)pyrazolo[1,5-a]pyrimidin-3-yl]-pyridin-2-ylmethanone;[7-(furan-2-yl)pyrazolo[1,5-a]pyrimidin-3-yl]-pyridin-3-ylmethanone;[7-(furan-2-yl)pyrazolo[1,5-a]pyrimidin-3-yl]-pyridin-4-ylmethanone;furan-2-yl-(7-thiophen-2-ylpyrazolo[1,5-a]pyrimidin-3-yl)methanone;pyridin-3-yl-(7-thiophen-2-ylpyrazolo[1,5-a]pyrimidin-3-yl)methanone;thiophen-2-yl-(7-thiophen-2-ylpyrazolo[1,5-a]pyrimidin-3-yl)methanone with MolForge

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Frequently Asked Questions

What is the IUPAC name of [4-(dimethylamino)phenyl]-[7-(furan-2-yl)pyrazolo[1,5-a]pyrimidin-3-yl]methanone;furan-2-yl-[7-(furan-2-yl)pyrazolo[1,5-a]pyrimidin-3-yl]methanone;[7-(furan-2-yl)pyrazolo[1,5-a]pyrimidin-3-yl]-pyridin-2-ylmethanone;[7-(furan-2-yl)pyrazolo[1,5-a]pyrimidin-3-yl]-pyridin-3-ylmethanone;[7-(furan-2-yl)pyrazolo[1,5-a]pyrimidin-3-yl]-pyridin-4-ylmethanone;furan-2-yl-(7-thiophen-2-ylpyrazolo[1,5-a]pyrimidin-3-yl)methanone;pyridin-3-yl-(7-thiophen-2-ylpyrazolo[1,5-a]pyrimidin-3-yl)methanone;thiophen-2-yl-(7-thiophen-2-ylpyrazolo[1,5-a]pyrimidin-3-yl)methanone?
The IUPAC name of [4-(dimethylamino)phenyl]-[7-(furan-2-yl)pyrazolo[1,5-a]pyrimidin-3-yl]methanone;furan-2-yl-[7-(furan-2-yl)pyrazolo[1,5-a]pyrimidin-3-yl]methanone;[7-(furan-2-yl)pyrazolo[1,5-a]pyrimidin-3-yl]-pyridin-2-ylmethanone;[7-(furan-2-yl)pyrazolo[1,5-a]pyrimidin-3-yl]-pyridin-3-ylmethanone;[7-(furan-2-yl)pyrazolo[1,5-a]pyrimidin-3-yl]-pyridin-4-ylmethanone;furan-2-yl-(7-thiophen-2-ylpyrazolo[1,5-a]pyrimidin-3-yl)methanone;pyridin-3-yl-(7-thiophen-2-ylpyrazolo[1,5-a]pyrimidin-3-yl)methanone;thiophen-2-yl-(7-thiophen-2-ylpyrazolo[1,5-a]pyrimidin-3-yl)methanone (CID 173417465) is [4-(dimethylamino)phenyl]-[7-(furan-2-yl)pyrazolo[1,5-a]pyrimidin-3-yl]methanone;furan-2-yl-[7-(furan-2-yl)pyrazolo[1,5-a]pyrimidin-3-yl]methanone;[7-(furan-2-yl)pyrazolo[1,5-a]pyrimidin-3-yl]-pyridin-2-ylmethanone;[7-(furan-2-yl)pyrazolo[1,5-a]pyrimidin-3-yl]-pyridin-3-ylmethanone;[7-(furan-2-yl)pyrazolo[1,5-a]pyrimidin-3-yl]-pyridin-4-ylmethanone;furan-2-yl-(7-thiophen-2-ylpyrazolo[1,5-a]pyrimidin-3-yl)methanone;pyridin-3-yl-(7-thiophen-2-ylpyrazolo[1,5-a]pyrimidin-3-yl)methanone;thiophen-2-yl-(7-thiophen-2-ylpyrazolo[1,5-a]pyrimidin-3-yl)methanone.
What is the SMILES notation for [4-(dimethylamino)phenyl]-[7-(furan-2-yl)pyrazolo[1,5-a]pyrimidin-3-yl]methanone;furan-2-yl-[7-(furan-2-yl)pyrazolo[1,5-a]pyrimidin-3-yl]methanone;[7-(furan-2-yl)pyrazolo[1,5-a]pyrimidin-3-yl]-pyridin-2-ylmethanone;[7-(furan-2-yl)pyrazolo[1,5-a]pyrimidin-3-yl]-pyridin-3-ylmethanone;[7-(furan-2-yl)pyrazolo[1,5-a]pyrimidin-3-yl]-pyridin-4-ylmethanone;furan-2-yl-(7-thiophen-2-ylpyrazolo[1,5-a]pyrimidin-3-yl)methanone;pyridin-3-yl-(7-thiophen-2-ylpyrazolo[1,5-a]pyrimidin-3-yl)methanone;thiophen-2-yl-(7-thiophen-2-ylpyrazolo[1,5-a]pyrimidin-3-yl)methanone?
The canonical SMILES for [4-(dimethylamino)phenyl]-[7-(furan-2-yl)pyrazolo[1,5-a]pyrimidin-3-yl]methanone;furan-2-yl-[7-(furan-2-yl)pyrazolo[1,5-a]pyrimidin-3-yl]methanone;[7-(furan-2-yl)pyrazolo[1,5-a]pyrimidin-3-yl]-pyridin-2-ylmethanone;[7-(furan-2-yl)pyrazolo[1,5-a]pyrimidin-3-yl]-pyridin-3-ylmethanone;[7-(furan-2-yl)pyrazolo[1,5-a]pyrimidin-3-yl]-pyridin-4-ylmethanone;furan-2-yl-(7-thiophen-2-ylpyrazolo[1,5-a]pyrimidin-3-yl)methanone;pyridin-3-yl-(7-thiophen-2-ylpyrazolo[1,5-a]pyrimidin-3-yl)methanone;thiophen-2-yl-(7-thiophen-2-ylpyrazolo[1,5-a]pyrimidin-3-yl)methanone is CN(C)c1ccc(C(=O)c2cnn3c(-c4ccco4)ccnc23)cc1.O=C(c1ccccn1)c1cnn2c(-c3ccco3)ccnc12.O=C(c1cccnc1)c1cnn2c(-c3ccco3)ccnc12.O=C(c1cccnc1)c1cnn2c(-c3cccs3)ccnc12.O=C(c1ccco1)c1cnn2c(-c3ccco3)ccnc12.O=C(c1ccco1)c1cnn2c(-c3cccs3)ccnc12.O=C(c1cccs1)c1cnn2c(-c3cccs3)ccnc12.O=C(c1ccncc1)c1cnn2c(-c3ccco3)ccnc12.
What is the InChIKey of [4-(dimethylamino)phenyl]-[7-(furan-2-yl)pyrazolo[1,5-a]pyrimidin-3-yl]methanone;furan-2-yl-[7-(furan-2-yl)pyrazolo[1,5-a]pyrimidin-3-yl]methanone;[7-(furan-2-yl)pyrazolo[1,5-a]pyrimidin-3-yl]-pyridin-2-ylmethanone;[7-(furan-2-yl)pyrazolo[1,5-a]pyrimidin-3-yl]-pyridin-3-ylmethanone;[7-(furan-2-yl)pyrazolo[1,5-a]pyrimidin-3-yl]-pyridin-4-ylmethanone;furan-2-yl-(7-thiophen-2-ylpyrazolo[1,5-a]pyrimidin-3-yl)methanone;pyridin-3-yl-(7-thiophen-2-ylpyrazolo[1,5-a]pyrimidin-3-yl)methanone;thiophen-2-yl-(7-thiophen-2-ylpyrazolo[1,5-a]pyrimidin-3-yl)methanone?
The InChIKey is XYJKTEFHIUKBDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N4O2.3C16H10N4O2.C16H10N4OS.C15H9N3O3.C15H9N3O2S.C15H9N3OS2/c1-22(2)14-7-5-13(6-8-14)18(24)15-12-21-23-16(9-10-20-19(15)23)17-4-3-11-25-17;21-15(11-3-1-6-17-9-11)12-10-19-20-13(5-7-18-16(12)20)14-4-2-8-22-14;21-15(11-3-6-17-7-4-11)12-10-19-20-13(5-8-18-16(12)20)14-2-1-9-22-14;21-15(12-4-1-2-7-17-12)11-10-19-20-13(6-8-18-16(11)20)14-5-3-9-22-14;21-15(11-3-1-6-17-9-11)12-10-19-20-13(5-7-18-16(12)20)14-4-2-8-22-14;19-14(13-4-2-8-21-13)10-9-17-18-11(5-6-16-15(10)18)12-3-1-7-20-12;19-14(12-3-1-7-20-12)10-9-17-18-11(5-6-16-15(10)18)13-4-2-8-21-13;19-14(13-4-2-8-21-13)10-9-17-18-11(5-6-16-15(10)18)12-3-1-7-20-12/h3-12H,1-2H3;4*1-10H;3*1-9H.
What are the key properties of [4-(dimethylamino)phenyl]-[7-(furan-2-yl)pyrazolo[1,5-a]pyrimidin-3-yl]methanone;furan-2-yl-[7-(furan-2-yl)pyrazolo[1,5-a]pyrimidin-3-yl]methanone;[7-(furan-2-yl)pyrazolo[1,5-a]pyrimidin-3-yl]-pyridin-2-ylmethanone;[7-(furan-2-yl)pyrazolo[1,5-a]pyrimidin-3-yl]-pyridin-3-ylmethanone;[7-(furan-2-yl)pyrazolo[1,5-a]pyrimidin-3-yl]-pyridin-4-ylmethanone;furan-2-yl-(7-thiophen-2-ylpyrazolo[1,5-a]pyrimidin-3-yl)methanone;pyridin-3-yl-(7-thiophen-2-ylpyrazolo[1,5-a]pyrimidin-3-yl)methanone;thiophen-2-yl-(7-thiophen-2-ylpyrazolo[1,5-a]pyrimidin-3-yl)methanone?
[4-(dimethylamino)phenyl]-[7-(furan-2-yl)pyrazolo[1,5-a]pyrimidin-3-yl]methanone;furan-2-yl-[7-(furan-2-yl)pyrazolo[1,5-a]pyrimidin-3-yl]methanone;[7-(furan-2-yl)pyrazolo[1,5-a]pyrimidin-3-yl]-pyridin-2-ylmethanone;[7-(furan-2-yl)pyrazolo[1,5-a]pyrimidin-3-yl]-pyridin-3-ylmethanone;[7-(furan-2-yl)pyrazolo[1,5-a]pyrimidin-3-yl]-pyridin-4-ylmethanone;furan-2-yl-(7-thiophen-2-ylpyrazolo[1,5-a]pyrimidin-3-yl)methanone;pyridin-3-yl-(7-thiophen-2-ylpyrazolo[1,5-a]pyrimidin-3-yl)methanone;thiophen-2-yl-(7-thiophen-2-ylpyrazolo[1,5-a]pyrimidin-3-yl)methanone has a molecular weight of 2395.53 g/mol, XLogP of 24.06, 25 rotatable bonds, 0 hydrogen bond donors, and 48 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(dimethylamino)phenyl]-[7-(furan-2-yl)pyrazolo[1,5-a]pyrimidin-3-yl]methanone;furan-2-yl-[7-(furan-2-yl)pyrazolo[1,5-a]pyrimidin-3-yl]methanone;[7-(furan-2-yl)pyrazolo[1,5-a]pyrimidin-3-yl]-pyridin-2-ylmethanone;[7-(furan-2-yl)pyrazolo[1,5-a]pyrimidin-3-yl]-pyridin-3-ylmethanone;[7-(furan-2-yl)pyrazolo[1,5-a]pyrimidin-3-yl]-pyridin-4-ylmethanone;furan-2-yl-(7-thiophen-2-ylpyrazolo[1,5-a]pyrimidin-3-yl)methanone;pyridin-3-yl-(7-thiophen-2-ylpyrazolo[1,5-a]pyrimidin-3-yl)methanone;thiophen-2-yl-(7-thiophen-2-ylpyrazolo[1,5-a]pyrimidin-3-yl)methanone is sourced from PubChem (CID 173417465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).