5-(4-amino-2-methylpyrimidin-5-yl)oxy-2-methoxy-6-propan-2-ylpyridine-3-carbonitrile;5-(4-amino-2-methylpyrimidin-5-yl)oxy-2-methoxy-6-propan-2-ylpyridine-3-sulfonamide;5-(2-ethyl-5-iodo-4-methoxyphenyl)sulfanyl-2-methylpyrimidin-4-amine;5-[(5-ethynyl-6-methoxy-2-propan-2-yl-3-pyridinyl)oxy]-2-methylpyrimidin-4-amine;5-[(5-iodo-6-methoxy-2-propan-2-yl-3-pyridinyl)oxy]-2-methylpyrimidin-4-amine;5-[(6-methoxy-5-methylsulfonyl-2-propan-2-yl-3-pyridinyl)oxy]-2-methylpyrimidin-4-amine;5-[[6-methoxy-2-propan-2-yl-5-(trifluoromethyl)-3-pyridinyl]oxy]-2-methylpyrimidin-4-amine

C103H124F3I2N29O17S3 — CID 158874272

About 5-(4-amino-2-methylpyrimidin-5-yl)oxy-2-methoxy-6-propan-2-ylpyridine-3-carbonitrile;5-(4-amino-2-methylpyrimidin-5-yl)oxy-2-methoxy-6-propan-2-ylpyridine-3-sulfonamide;5-(2-ethyl-5-iodo-4-methoxyphenyl)sulfanyl-2-methylpyrimidin-4-amine;5-[(5-ethynyl-6-methoxy-2-propan-2-yl-3-pyridinyl)oxy]-2-methylpyrimidin-4-amine;5-[(5-iodo-6-methoxy-2-propan-2-yl-3-pyridinyl)oxy]-2-methylpyrimidin-4-amine;5-[(6-methoxy-5-methylsulfonyl-2-propan-2-yl-3-pyridinyl)oxy]-2-methylpyrimidin-4-amine;5-[[6-methoxy-2-propan-2-yl-5-(trifluoromethyl)-3-pyridinyl]oxy]-2-methylpyrimidin-4-amine

5-(4-amino-2-methylpyrimidin-5-yl)oxy-2-methoxy-6-propan-2-ylpyridine-3-carbonitrile;5-(4-amino-2-methylpyrimidin-5-yl)oxy-2-methoxy-6-propan-2-ylpyridine-3-sulfonamide;5-(2-ethyl-5-iodo-4-methoxyphenyl)sulfanyl-2-methylpyrimidin-4-amine;5-[(5-ethynyl-6-methoxy-2-propan-2-yl-3-pyridinyl)oxy]-2-methylpyrimidin-4-amine;5-[(5-iodo-6-methoxy-2-propan-2-yl-3-pyridinyl)oxy]-2-methylpyrimidin-4-amine;5-[(6-methoxy-5-methylsulfonyl-2-propan-2-yl-3-pyridinyl)oxy]-2-methylpyrimidin-4-amine;5-[[6-methoxy-2-propan-2-yl-5-(trifluoromethyl)-3-pyridinyl]oxy]-2-methylpyrimidin-4-amine (PubChem CID 158874272) has the molecular formula C103H124F3I2N29O17S3 and a molecular weight of 2447.31 g/mol. Its IUPAC name is 5-(4-amino-2-methylpyrimidin-5-yl)oxy-2-methoxy-6-propan-2-ylpyridine-3-carbonitrile;5-(4-amino-2-methylpyrimidin-5-yl)oxy-2-methoxy-6-propan-2-ylpyridine-3-sulfonamide;5-(2-ethyl-5-iodo-4-methoxyphenyl)sulfanyl-2-methylpyrimidin-4-amine;5-[(5-ethynyl-6-methoxy-2-propan-2-yl-3-pyridinyl)oxy]-2-methylpyrimidin-4-amine;5-[(5-iodo-6-methoxy-2-propan-2-yl-3-pyridinyl)oxy]-2-methylpyrimidin-4-amine;5-[(6-methoxy-5-methylsulfonyl-2-propan-2-yl-3-pyridinyl)oxy]-2-methylpyrimidin-4-amine;5-[[6-methoxy-2-propan-2-yl-5-(trifluoromethyl)-3-pyridinyl]oxy]-2-methylpyrimidin-4-amine.

Molecular Properties

• Compound Name: 5-(4-amino-2-methylpyrimidin-5-yl)oxy-2-methoxy-6-propan-2-ylpyridine-3-carbonitrile;5-(4-amino-2-methylpyrimidin-5-yl)oxy-2-methoxy-6-propan-2-ylpyridine-3-sulfonamide;5-(2-ethyl-5-iodo-4-methoxyphenyl)sulfanyl-2-methylpyrimidin-4-amine;5-[(5-ethynyl-6-methoxy-2-propan-2-yl-3-pyridinyl)oxy]-2-methylpyrimidin-4-amine;5-[(5-iodo-6-methoxy-2-propan-2-yl-3-pyridinyl)oxy]-2-methylpyrimidin-4-amine;5-[(6-methoxy-5-methylsulfonyl-2-propan-2-yl-3-pyridinyl)oxy]-2-methylpyrimidin-4-amine;5-[[6-methoxy-2-propan-2-yl-5-(trifluoromethyl)-3-pyridinyl]oxy]-2-methylpyrimidin-4-amine
• PubChem CID: 158874272
• Molecular Formula: C103H124F3I2N29O17S3
• Molecular Weight: 2447.31 g/mol
• Exact Mass: 2445.69
• IUPAC Name: 5-(4-amino-2-methylpyrimidin-5-yl)oxy-2-methoxy-6-propan-2-ylpyridine-3-carbonitrile;5-(4-amino-2-methylpyrimidin-5-yl)oxy-2-methoxy-6-propan-2-ylpyridine-3-sulfonamide;5-(2-ethyl-5-iodo-4-methoxyphenyl)sulfanyl-2-methylpyrimidin-4-amine;5-[(5-ethynyl-6-methoxy-2-propan-2-yl-3-pyridinyl)oxy]-2-methylpyrimidin-4-amine;5-[(5-iodo-6-methoxy-2-propan-2-yl-3-pyridinyl)oxy]-2-methylpyrimidin-4-amine;5-[(6-methoxy-5-methylsulfonyl-2-propan-2-yl-3-pyridinyl)oxy]-2-methylpyrimidin-4-amine;5-[[6-methoxy-2-propan-2-yl-5-(trifluoromethyl)-3-pyridinyl]oxy]-2-methylpyrimidin-4-amine
• SMILES: C#Cc1cc(Oc2cnc(C)nc2N)c(C(C)C)nc1OC.CCc1cc(OC)c(I)cc1Sc1cnc(C)nc1N.COc1nc(C(C)C)c(Oc2cnc(C)nc2N)cc1C#N.COc1nc(C(C)C)c(Oc2cnc(C)nc2N)cc1C(F)(F)F.COc1nc(C(C)C)c(Oc2cnc(C)nc2N)cc1I.COc1nc(C(C)C)c(Oc2cnc(C)nc2N)cc1S(C)(=O)=O.COc1nc(C(C)C)c(Oc2cnc(C)nc2N)cc1S(N)(=O)=O
• InChI: InChI=1S/C16H18N4O2.C15H17F3N4O2.C15H17N5O2.C15H20N4O4S.C14H17IN4O2.C14H16IN3OS.C14H19N5O4S/c1-6-11-7-12(14(9(2)3)20-16(11)21-5)22-13-8-18-10(4)19-15(13)17;1-7(2)12-10(24-11-6-20-8(3)21-13(11)19)5-9(15(16,17)18)14(22-12)23-4;1-8(2)13-11(5-10(6-16)15(20-13)21-4)22-12-7-18-9(3)19-14(12)17;1-8(2)13-10(23-11-7-17-9(3)18-14(11)16)6-12(24(5,20)21)15(19-13)22-4;1-7(2)12-10(5-9(15)14(19-12)20-4)21-11-6-17-8(3)18-13(11)16;1-4-9-5-11(19-3)10(15)6-12(9)20-13-7-17-8(2)18-14(13)16;1-7(2)12-9(23-10-6-17-8(3)18-13(10)15)5-11(24(16,20)21)14(19-12)22-4/h1,7-9H,2-5H3,(H2,17,18,19);5-7H,1-4H3,(H2,19,20,21);5,7-8H,1-4H3,(H2,17,18,19);6-8H,1-5H3,(H2,16,17,18);5-7H,1-4H3,(H2,16,17,18);5-7H,4H2,1-3H3,(H2,16,17,18);5-7H,1-4H3,(H2,15,17,18)(H2,16,20,21)
• InChIKey: JCFWLBXDPCRHKR-UHFFFAOYSA-N
• XLogP: 19.34
• TPSA: 678.02 Ų
• H-Bond Donors: 8
• H-Bond Acceptors: 46
• Rotatable Bonds: 30
• Heavy Atoms: 157
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2447.31
LogP ≤ 5	19.34
H-Bond Donors ≤ 5	8
H-Bond Acceptors ≤ 10	46

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'iodine', 'substructure': 'N/A'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 5-(4-amino-2-methylpyrimidin-5-yl)oxy-2-methoxy-6-propan-2-ylpyridine-3-carbonitrile;5-(4-amino-2-methylpyrimidin-5-yl)oxy-2-methoxy-6-propan-2-ylpyridine-3-sulfonamide;5-(2-ethyl-5-iodo-4-methoxyphenyl)sulfanyl-2-methylpyrimidin-4-amine;5-[(5-ethynyl-6-methoxy-2-propan-2-yl-3-pyridinyl)oxy]-2-methylpyrimidin-4-amine;5-[(5-iodo-6-methoxy-2-propan-2-yl-3-pyridinyl)oxy]-2-methylpyrimidin-4-amine;5-[(6-methoxy-5-methylsulfonyl-2-propan-2-yl-3-pyridinyl)oxy]-2-methylpyrimidin-4-amine;5-[[6-methoxy-2-propan-2-yl-5-(trifluoromethyl)-3-pyridinyl]oxy]-2-methylpyrimidin-4-amine?

The IUPAC name of 5-(4-amino-2-methylpyrimidin-5-yl)oxy-2-methoxy-6-propan-2-ylpyridine-3-carbonitrile;5-(4-amino-2-methylpyrimidin-5-yl)oxy-2-methoxy-6-propan-2-ylpyridine-3-sulfonamide;5-(2-ethyl-5-iodo-4-methoxyphenyl)sulfanyl-2-methylpyrimidin-4-amine;5-[(5-ethynyl-6-methoxy-2-propan-2-yl-3-pyridinyl)oxy]-2-methylpyrimidin-4-amine;5-[(5-iodo-6-methoxy-2-propan-2-yl-3-pyridinyl)oxy]-2-methylpyrimidin-4-amine;5-[(6-methoxy-5-methylsulfonyl-2-propan-2-yl-3-pyridinyl)oxy]-2-methylpyrimidin-4-amine;5-[[6-methoxy-2-propan-2-yl-5-(trifluoromethyl)-3-pyridinyl]oxy]-2-methylpyrimidin-4-amine (CID 158874272) is 5-(4-amino-2-methylpyrimidin-5-yl)oxy-2-methoxy-6-propan-2-ylpyridine-3-carbonitrile;5-(4-amino-2-methylpyrimidin-5-yl)oxy-2-methoxy-6-propan-2-ylpyridine-3-sulfonamide;5-(2-ethyl-5-iodo-4-methoxyphenyl)sulfanyl-2-methylpyrimidin-4-amine;5-[(5-ethynyl-6-methoxy-2-propan-2-yl-3-pyridinyl)oxy]-2-methylpyrimidin-4-amine;5-[(5-iodo-6-methoxy-2-propan-2-yl-3-pyridinyl)oxy]-2-methylpyrimidin-4-amine;5-[(6-methoxy-5-methylsulfonyl-2-propan-2-yl-3-pyridinyl)oxy]-2-methylpyrimidin-4-amine;5-[[6-methoxy-2-propan-2-yl-5-(trifluoromethyl)-3-pyridinyl]oxy]-2-methylpyrimidin-4-amine.

What is the SMILES notation for 5-(4-amino-2-methylpyrimidin-5-yl)oxy-2-methoxy-6-propan-2-ylpyridine-3-carbonitrile;5-(4-amino-2-methylpyrimidin-5-yl)oxy-2-methoxy-6-propan-2-ylpyridine-3-sulfonamide;5-(2-ethyl-5-iodo-4-methoxyphenyl)sulfanyl-2-methylpyrimidin-4-amine;5-[(5-ethynyl-6-methoxy-2-propan-2-yl-3-pyridinyl)oxy]-2-methylpyrimidin-4-amine;5-[(5-iodo-6-methoxy-2-propan-2-yl-3-pyridinyl)oxy]-2-methylpyrimidin-4-amine;5-[(6-methoxy-5-methylsulfonyl-2-propan-2-yl-3-pyridinyl)oxy]-2-methylpyrimidin-4-amine;5-[[6-methoxy-2-propan-2-yl-5-(trifluoromethyl)-3-pyridinyl]oxy]-2-methylpyrimidin-4-amine?

The canonical SMILES for 5-(4-amino-2-methylpyrimidin-5-yl)oxy-2-methoxy-6-propan-2-ylpyridine-3-carbonitrile;5-(4-amino-2-methylpyrimidin-5-yl)oxy-2-methoxy-6-propan-2-ylpyridine-3-sulfonamide;5-(2-ethyl-5-iodo-4-methoxyphenyl)sulfanyl-2-methylpyrimidin-4-amine;5-[(5-ethynyl-6-methoxy-2-propan-2-yl-3-pyridinyl)oxy]-2-methylpyrimidin-4-amine;5-[(5-iodo-6-methoxy-2-propan-2-yl-3-pyridinyl)oxy]-2-methylpyrimidin-4-amine;5-[(6-methoxy-5-methylsulfonyl-2-propan-2-yl-3-pyridinyl)oxy]-2-methylpyrimidin-4-amine;5-[[6-methoxy-2-propan-2-yl-5-(trifluoromethyl)-3-pyridinyl]oxy]-2-methylpyrimidin-4-amine is C#Cc1cc(Oc2cnc(C)nc2N)c(C(C)C)nc1OC.CCc1cc(OC)c(I)cc1Sc1cnc(C)nc1N.COc1nc(C(C)C)c(Oc2cnc(C)nc2N)cc1C#N.COc1nc(C(C)C)c(Oc2cnc(C)nc2N)cc1C(F)(F)F.COc1nc(C(C)C)c(Oc2cnc(C)nc2N)cc1I.COc1nc(C(C)C)c(Oc2cnc(C)nc2N)cc1S(C)(=O)=O.COc1nc(C(C)C)c(Oc2cnc(C)nc2N)cc1S(N)(=O)=O.

What is the InChIKey of 5-(4-amino-2-methylpyrimidin-5-yl)oxy-2-methoxy-6-propan-2-ylpyridine-3-carbonitrile;5-(4-amino-2-methylpyrimidin-5-yl)oxy-2-methoxy-6-propan-2-ylpyridine-3-sulfonamide;5-(2-ethyl-5-iodo-4-methoxyphenyl)sulfanyl-2-methylpyrimidin-4-amine;5-[(5-ethynyl-6-methoxy-2-propan-2-yl-3-pyridinyl)oxy]-2-methylpyrimidin-4-amine;5-[(5-iodo-6-methoxy-2-propan-2-yl-3-pyridinyl)oxy]-2-methylpyrimidin-4-amine;5-[(6-methoxy-5-methylsulfonyl-2-propan-2-yl-3-pyridinyl)oxy]-2-methylpyrimidin-4-amine;5-[[6-methoxy-2-propan-2-yl-5-(trifluoromethyl)-3-pyridinyl]oxy]-2-methylpyrimidin-4-amine?

The InChIKey is JCFWLBXDPCRHKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N4O2.C15H17F3N4O2.C15H17N5O2.C15H20N4O4S.C14H17IN4O2.C14H16IN3OS.C14H19N5O4S/c1-6-11-7-12(14(9(2)3)20-16(11)21-5)22-13-8-18-10(4)19-15(13)17;1-7(2)12-10(24-11-6-20-8(3)21-13(11)19)5-9(15(16,17)18)14(22-12)23-4;1-8(2)13-11(5-10(6-16)15(20-13)21-4)22-12-7-18-9(3)19-14(12)17;1-8(2)13-10(23-11-7-17-9(3)18-14(11)16)6-12(24(5,20)21)15(19-13)22-4;1-7(2)12-10(5-9(15)14(19-12)20-4)21-11-6-17-8(3)18-13(11)16;1-4-9-5-11(19-3)10(15)6-12(9)20-13-7-17-8(2)18-14(13)16;1-7(2)12-9(23-10-6-17-8(3)18-13(10)15)5-11(24(16,20)21)14(19-12)22-4/h1,7-9H,2-5H3,(H2,17,18,19);5-7H,1-4H3,(H2,19,20,21);5,7-8H,1-4H3,(H2,17,18,19);6-8H,1-5H3,(H2,16,17,18);5-7H,1-4H3,(H2,16,17,18);5-7H,4H2,1-3H3,(H2,16,17,18);5-7H,1-4H3,(H2,15,17,18)(H2,16,20,21).

What are the key properties of 5-(4-amino-2-methylpyrimidin-5-yl)oxy-2-methoxy-6-propan-2-ylpyridine-3-carbonitrile;5-(4-amino-2-methylpyrimidin-5-yl)oxy-2-methoxy-6-propan-2-ylpyridine-3-sulfonamide;5-(2-ethyl-5-iodo-4-methoxyphenyl)sulfanyl-2-methylpyrimidin-4-amine;5-[(5-ethynyl-6-methoxy-2-propan-2-yl-3-pyridinyl)oxy]-2-methylpyrimidin-4-amine;5-[(5-iodo-6-methoxy-2-propan-2-yl-3-pyridinyl)oxy]-2-methylpyrimidin-4-amine;5-[(6-methoxy-5-methylsulfonyl-2-propan-2-yl-3-pyridinyl)oxy]-2-methylpyrimidin-4-amine;5-[[6-methoxy-2-propan-2-yl-5-(trifluoromethyl)-3-pyridinyl]oxy]-2-methylpyrimidin-4-amine?

5-(4-amino-2-methylpyrimidin-5-yl)oxy-2-methoxy-6-propan-2-ylpyridine-3-carbonitrile;5-(4-amino-2-methylpyrimidin-5-yl)oxy-2-methoxy-6-propan-2-ylpyridine-3-sulfonamide;5-(2-ethyl-5-iodo-4-methoxyphenyl)sulfanyl-2-methylpyrimidin-4-amine;5-[(5-ethynyl-6-methoxy-2-propan-2-yl-3-pyridinyl)oxy]-2-methylpyrimidin-4-amine;5-[(5-iodo-6-methoxy-2-propan-2-yl-3-pyridinyl)oxy]-2-methylpyrimidin-4-amine;5-[(6-methoxy-5-methylsulfonyl-2-propan-2-yl-3-pyridinyl)oxy]-2-methylpyrimidin-4-amine;5-[[6-methoxy-2-propan-2-yl-5-(trifluoromethyl)-3-pyridinyl]oxy]-2-methylpyrimidin-4-amine has a molecular weight of 2447.31 g/mol, XLogP of 19.34, 30 rotatable bonds, 8 hydrogen bond donors, and 46 hydrogen bond acceptors.

Where does this data come from?

All data for 5-(4-amino-2-methylpyrimidin-5-yl)oxy-2-methoxy-6-propan-2-ylpyridine-3-carbonitrile;5-(4-amino-2-methylpyrimidin-5-yl)oxy-2-methoxy-6-propan-2-ylpyridine-3-sulfonamide;5-(2-ethyl-5-iodo-4-methoxyphenyl)sulfanyl-2-methylpyrimidin-4-amine;5-[(5-ethynyl-6-methoxy-2-propan-2-yl-3-pyridinyl)oxy]-2-methylpyrimidin-4-amine;5-[(5-iodo-6-methoxy-2-propan-2-yl-3-pyridinyl)oxy]-2-methylpyrimidin-4-amine;5-[(6-methoxy-5-methylsulfonyl-2-propan-2-yl-3-pyridinyl)oxy]-2-methylpyrimidin-4-amine;5-[[6-methoxy-2-propan-2-yl-5-(trifluoromethyl)-3-pyridinyl]oxy]-2-methylpyrimidin-4-amine is sourced from PubChem (CID 158874272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).