1-methyl-4-propan-2-ylindazol-3-amine;1-methyl-3-propan-2-ylpyrazolo[3,4-d]pyrimidin-4-amine;7-methyl-5-propan-2-ylpyrrolo[2,3-d]pyrimidin-4-amine;3-propan-2-ylfuro[3,2-c]pyridin-4-amine;3-propan-2-yl-2H-pyrazolo[3,4-d]pyrimidin-4-amine;3-propan-2-yl-7-pyridin-3-ylthieno[3,2-c]pyridin-4-amine;3-propan-2-ylthieno[3,2-c]pyridin-4-amine;5-propan-2-ylthieno[2,3-d]pyrimidin-4-amine

C82H103N27OS3 — CID 158339778

About 1-methyl-4-propan-2-ylindazol-3-amine;1-methyl-3-propan-2-ylpyrazolo[3,4-d]pyrimidin-4-amine;7-methyl-5-propan-2-ylpyrrolo[2,3-d]pyrimidin-4-amine;3-propan-2-ylfuro[3,2-c]pyridin-4-amine;3-propan-2-yl-2H-pyrazolo[3,4-d]pyrimidin-4-amine;3-propan-2-yl-7-pyridin-3-ylthieno[3,2-c]pyridin-4-amine;3-propan-2-ylthieno[3,2-c]pyridin-4-amine;5-propan-2-ylthieno[2,3-d]pyrimidin-4-amine

1-methyl-4-propan-2-ylindazol-3-amine;1-methyl-3-propan-2-ylpyrazolo[3,4-d]pyrimidin-4-amine;7-methyl-5-propan-2-ylpyrrolo[2,3-d]pyrimidin-4-amine;3-propan-2-ylfuro[3,2-c]pyridin-4-amine;3-propan-2-yl-2H-pyrazolo[3,4-d]pyrimidin-4-amine;3-propan-2-yl-7-pyridin-3-ylthieno[3,2-c]pyridin-4-amine;3-propan-2-ylthieno[3,2-c]pyridin-4-amine;5-propan-2-ylthieno[2,3-d]pyrimidin-4-amine (PubChem CID 158339778) has the molecular formula C82H103N27OS3 and a molecular weight of 1579.11 g/mol. Its IUPAC name is 1-methyl-4-propan-2-ylindazol-3-amine;1-methyl-3-propan-2-ylpyrazolo[3,4-d]pyrimidin-4-amine;7-methyl-5-propan-2-ylpyrrolo[2,3-d]pyrimidin-4-amine;3-propan-2-ylfuro[3,2-c]pyridin-4-amine;3-propan-2-yl-2H-pyrazolo[3,4-d]pyrimidin-4-amine;3-propan-2-yl-7-pyridin-3-ylthieno[3,2-c]pyridin-4-amine;3-propan-2-ylthieno[3,2-c]pyridin-4-amine;5-propan-2-ylthieno[2,3-d]pyrimidin-4-amine.

Molecular Properties

• Compound Name: 1-methyl-4-propan-2-ylindazol-3-amine;1-methyl-3-propan-2-ylpyrazolo[3,4-d]pyrimidin-4-amine;7-methyl-5-propan-2-ylpyrrolo[2,3-d]pyrimidin-4-amine;3-propan-2-ylfuro[3,2-c]pyridin-4-amine;3-propan-2-yl-2H-pyrazolo[3,4-d]pyrimidin-4-amine;3-propan-2-yl-7-pyridin-3-ylthieno[3,2-c]pyridin-4-amine;3-propan-2-ylthieno[3,2-c]pyridin-4-amine;5-propan-2-ylthieno[2,3-d]pyrimidin-4-amine
• PubChem CID: 158339778
• Molecular Formula: C82H103N27OS3
• Molecular Weight: 1579.11 g/mol
• Exact Mass: 1577.80
• IUPAC Name: 1-methyl-4-propan-2-ylindazol-3-amine;1-methyl-3-propan-2-ylpyrazolo[3,4-d]pyrimidin-4-amine;7-methyl-5-propan-2-ylpyrrolo[2,3-d]pyrimidin-4-amine;3-propan-2-ylfuro[3,2-c]pyridin-4-amine;3-propan-2-yl-2H-pyrazolo[3,4-d]pyrimidin-4-amine;3-propan-2-yl-7-pyridin-3-ylthieno[3,2-c]pyridin-4-amine;3-propan-2-ylthieno[3,2-c]pyridin-4-amine;5-propan-2-ylthieno[2,3-d]pyrimidin-4-amine
• SMILES: CC(C)c1[nH]nc2ncnc(N)c12.CC(C)c1cccc2c1c(N)nn2C.CC(C)c1cn(C)c2ncnc(N)c12.CC(C)c1coc2ccnc(N)c12.CC(C)c1csc2c(-c3cccnc3)cnc(N)c12.CC(C)c1csc2ccnc(N)c12.CC(C)c1csc2ncnc(N)c12.CC(C)c1nn(C)c2ncnc(N)c12
• InChI: InChI=1S/C15H15N3S.C11H15N3.C10H14N4.C10H12N2O.C10H12N2S.C9H13N5.C9H11N3S.C8H11N5/c1-9(2)12-8-19-14-11(7-18-15(16)13(12)14)10-4-3-5-17-6-10;1-7(2)8-5-4-6-9-10(8)11(12)13-14(9)3;1-6(2)7-4-14(3)10-8(7)9(11)12-5-13-10;2*1-6(2)7-5-13-8-3-4-12-10(11)9(7)8;1-5(2)7-6-8(10)11-4-12-9(6)14(3)13-7;1-5(2)6-3-13-9-7(6)8(10)11-4-12-9;1-4(2)6-5-7(9)10-3-11-8(5)13-12-6/h3-9H,1-2H3,(H2,16,18);4-7H,1-3H3,(H2,12,13);4-6H,1-3H3,(H2,11,12,13);2*3-6H,1-2H3,(H2,11,12);4-5H,1-3H3,(H2,10,11,12);3-5H,1-2H3,(H2,10,11,12);3-4H,1-2H3,(H3,9,10,11,12,13)
• InChIKey: GRACQWAQOARREM-UHFFFAOYSA-N
• XLogP: 18.08
• TPSA: 445.23 Ų
• H-Bond Donors: 9
• H-Bond Acceptors: 30
• Rotatable Bonds: 9
• Heavy Atoms: 113
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1579.11
LogP ≤ 5	18.08
H-Bond Donors ≤ 5	9
H-Bond Acceptors ≤ 10	30

Frequently Asked Questions

What is the IUPAC name of 1-methyl-4-propan-2-ylindazol-3-amine;1-methyl-3-propan-2-ylpyrazolo[3,4-d]pyrimidin-4-amine;7-methyl-5-propan-2-ylpyrrolo[2,3-d]pyrimidin-4-amine;3-propan-2-ylfuro[3,2-c]pyridin-4-amine;3-propan-2-yl-2H-pyrazolo[3,4-d]pyrimidin-4-amine;3-propan-2-yl-7-pyridin-3-ylthieno[3,2-c]pyridin-4-amine;3-propan-2-ylthieno[3,2-c]pyridin-4-amine;5-propan-2-ylthieno[2,3-d]pyrimidin-4-amine?

The IUPAC name of 1-methyl-4-propan-2-ylindazol-3-amine;1-methyl-3-propan-2-ylpyrazolo[3,4-d]pyrimidin-4-amine;7-methyl-5-propan-2-ylpyrrolo[2,3-d]pyrimidin-4-amine;3-propan-2-ylfuro[3,2-c]pyridin-4-amine;3-propan-2-yl-2H-pyrazolo[3,4-d]pyrimidin-4-amine;3-propan-2-yl-7-pyridin-3-ylthieno[3,2-c]pyridin-4-amine;3-propan-2-ylthieno[3,2-c]pyridin-4-amine;5-propan-2-ylthieno[2,3-d]pyrimidin-4-amine (CID 158339778) is 1-methyl-4-propan-2-ylindazol-3-amine;1-methyl-3-propan-2-ylpyrazolo[3,4-d]pyrimidin-4-amine;7-methyl-5-propan-2-ylpyrrolo[2,3-d]pyrimidin-4-amine;3-propan-2-ylfuro[3,2-c]pyridin-4-amine;3-propan-2-yl-2H-pyrazolo[3,4-d]pyrimidin-4-amine;3-propan-2-yl-7-pyridin-3-ylthieno[3,2-c]pyridin-4-amine;3-propan-2-ylthieno[3,2-c]pyridin-4-amine;5-propan-2-ylthieno[2,3-d]pyrimidin-4-amine.

What is the SMILES notation for 1-methyl-4-propan-2-ylindazol-3-amine;1-methyl-3-propan-2-ylpyrazolo[3,4-d]pyrimidin-4-amine;7-methyl-5-propan-2-ylpyrrolo[2,3-d]pyrimidin-4-amine;3-propan-2-ylfuro[3,2-c]pyridin-4-amine;3-propan-2-yl-2H-pyrazolo[3,4-d]pyrimidin-4-amine;3-propan-2-yl-7-pyridin-3-ylthieno[3,2-c]pyridin-4-amine;3-propan-2-ylthieno[3,2-c]pyridin-4-amine;5-propan-2-ylthieno[2,3-d]pyrimidin-4-amine?

The canonical SMILES for 1-methyl-4-propan-2-ylindazol-3-amine;1-methyl-3-propan-2-ylpyrazolo[3,4-d]pyrimidin-4-amine;7-methyl-5-propan-2-ylpyrrolo[2,3-d]pyrimidin-4-amine;3-propan-2-ylfuro[3,2-c]pyridin-4-amine;3-propan-2-yl-2H-pyrazolo[3,4-d]pyrimidin-4-amine;3-propan-2-yl-7-pyridin-3-ylthieno[3,2-c]pyridin-4-amine;3-propan-2-ylthieno[3,2-c]pyridin-4-amine;5-propan-2-ylthieno[2,3-d]pyrimidin-4-amine is CC(C)c1[nH]nc2ncnc(N)c12.CC(C)c1cccc2c1c(N)nn2C.CC(C)c1cn(C)c2ncnc(N)c12.CC(C)c1coc2ccnc(N)c12.CC(C)c1csc2c(-c3cccnc3)cnc(N)c12.CC(C)c1csc2ccnc(N)c12.CC(C)c1csc2ncnc(N)c12.CC(C)c1nn(C)c2ncnc(N)c12.

What is the InChIKey of 1-methyl-4-propan-2-ylindazol-3-amine;1-methyl-3-propan-2-ylpyrazolo[3,4-d]pyrimidin-4-amine;7-methyl-5-propan-2-ylpyrrolo[2,3-d]pyrimidin-4-amine;3-propan-2-ylfuro[3,2-c]pyridin-4-amine;3-propan-2-yl-2H-pyrazolo[3,4-d]pyrimidin-4-amine;3-propan-2-yl-7-pyridin-3-ylthieno[3,2-c]pyridin-4-amine;3-propan-2-ylthieno[3,2-c]pyridin-4-amine;5-propan-2-ylthieno[2,3-d]pyrimidin-4-amine?

The InChIKey is GRACQWAQOARREM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3S.C11H15N3.C10H14N4.C10H12N2O.C10H12N2S.C9H13N5.C9H11N3S.C8H11N5/c1-9(2)12-8-19-14-11(7-18-15(16)13(12)14)10-4-3-5-17-6-10;1-7(2)8-5-4-6-9-10(8)11(12)13-14(9)3;1-6(2)7-4-14(3)10-8(7)9(11)12-5-13-10;2*1-6(2)7-5-13-8-3-4-12-10(11)9(7)8;1-5(2)7-6-8(10)11-4-12-9(6)14(3)13-7;1-5(2)6-3-13-9-7(6)8(10)11-4-12-9;1-4(2)6-5-7(9)10-3-11-8(5)13-12-6/h3-9H,1-2H3,(H2,16,18);4-7H,1-3H3,(H2,12,13);4-6H,1-3H3,(H2,11,12,13);2*3-6H,1-2H3,(H2,11,12);4-5H,1-3H3,(H2,10,11,12);3-5H,1-2H3,(H2,10,11,12);3-4H,1-2H3,(H3,9,10,11,12,13).

What are the key properties of 1-methyl-4-propan-2-ylindazol-3-amine;1-methyl-3-propan-2-ylpyrazolo[3,4-d]pyrimidin-4-amine;7-methyl-5-propan-2-ylpyrrolo[2,3-d]pyrimidin-4-amine;3-propan-2-ylfuro[3,2-c]pyridin-4-amine;3-propan-2-yl-2H-pyrazolo[3,4-d]pyrimidin-4-amine;3-propan-2-yl-7-pyridin-3-ylthieno[3,2-c]pyridin-4-amine;3-propan-2-ylthieno[3,2-c]pyridin-4-amine;5-propan-2-ylthieno[2,3-d]pyrimidin-4-amine?

1-methyl-4-propan-2-ylindazol-3-amine;1-methyl-3-propan-2-ylpyrazolo[3,4-d]pyrimidin-4-amine;7-methyl-5-propan-2-ylpyrrolo[2,3-d]pyrimidin-4-amine;3-propan-2-ylfuro[3,2-c]pyridin-4-amine;3-propan-2-yl-2H-pyrazolo[3,4-d]pyrimidin-4-amine;3-propan-2-yl-7-pyridin-3-ylthieno[3,2-c]pyridin-4-amine;3-propan-2-ylthieno[3,2-c]pyridin-4-amine;5-propan-2-ylthieno[2,3-d]pyrimidin-4-amine has a molecular weight of 1579.11 g/mol, XLogP of 18.08, 9 rotatable bonds, 9 hydrogen bond donors, and 30 hydrogen bond acceptors.

Where does this data come from?

All data for 1-methyl-4-propan-2-ylindazol-3-amine;1-methyl-3-propan-2-ylpyrazolo[3,4-d]pyrimidin-4-amine;7-methyl-5-propan-2-ylpyrrolo[2,3-d]pyrimidin-4-amine;3-propan-2-ylfuro[3,2-c]pyridin-4-amine;3-propan-2-yl-2H-pyrazolo[3,4-d]pyrimidin-4-amine;3-propan-2-yl-7-pyridin-3-ylthieno[3,2-c]pyridin-4-amine;3-propan-2-ylthieno[3,2-c]pyridin-4-amine;5-propan-2-ylthieno[2,3-d]pyrimidin-4-amine is sourced from PubChem (CID 158339778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).