[4-(2-amino-6-ethylpyrimidin-4-yl)phenyl]methanol;6-[1-(4-chlorophenyl)sulfonylindol-3-yl]-4-N-methylpyrimidine-2,4-diamine;4-ethyl-6-(1H-isoindol-5-yl)pyrimidin-2-amine;4-ethyl-6-(4-methyl-1H-isoindol-5-yl)pyrimidin-2-amine;4-ethyl-6-(6-methyl-1H-isoindol-5-yl)pyrimidin-2-amine;4-ethyl-6-(2-methylphenyl)pyrimidin-2-amine;4-ethyl-6-(3-methylphenyl)pyrimidin-2-amine

C102H107ClN26O3S — CID 161384477

About [4-(2-amino-6-ethylpyrimidin-4-yl)phenyl]methanol;6-[1-(4-chlorophenyl)sulfonylindol-3-yl]-4-N-methylpyrimidine-2,4-diamine;4-ethyl-6-(1H-isoindol-5-yl)pyrimidin-2-amine;4-ethyl-6-(4-methyl-1H-isoindol-5-yl)pyrimidin-2-amine;4-ethyl-6-(6-methyl-1H-isoindol-5-yl)pyrimidin-2-amine;4-ethyl-6-(2-methylphenyl)pyrimidin-2-amine;4-ethyl-6-(3-methylphenyl)pyrimidin-2-amine

[4-(2-amino-6-ethylpyrimidin-4-yl)phenyl]methanol;6-[1-(4-chlorophenyl)sulfonylindol-3-yl]-4-N-methylpyrimidine-2,4-diamine;4-ethyl-6-(1H-isoindol-5-yl)pyrimidin-2-amine;4-ethyl-6-(4-methyl-1H-isoindol-5-yl)pyrimidin-2-amine;4-ethyl-6-(6-methyl-1H-isoindol-5-yl)pyrimidin-2-amine;4-ethyl-6-(2-methylphenyl)pyrimidin-2-amine;4-ethyl-6-(3-methylphenyl)pyrimidin-2-amine (PubChem CID 161384477) has the molecular formula C102H107ClN26O3S and a molecular weight of 1812.68 g/mol. Its IUPAC name is [4-(2-amino-6-ethylpyrimidin-4-yl)phenyl]methanol;6-[1-(4-chlorophenyl)sulfonylindol-3-yl]-4-N-methylpyrimidine-2,4-diamine;4-ethyl-6-(1H-isoindol-5-yl)pyrimidin-2-amine;4-ethyl-6-(4-methyl-1H-isoindol-5-yl)pyrimidin-2-amine;4-ethyl-6-(6-methyl-1H-isoindol-5-yl)pyrimidin-2-amine;4-ethyl-6-(2-methylphenyl)pyrimidin-2-amine;4-ethyl-6-(3-methylphenyl)pyrimidin-2-amine.

Molecular Properties

• Compound Name: [4-(2-amino-6-ethylpyrimidin-4-yl)phenyl]methanol;6-[1-(4-chlorophenyl)sulfonylindol-3-yl]-4-N-methylpyrimidine-2,4-diamine;4-ethyl-6-(1H-isoindol-5-yl)pyrimidin-2-amine;4-ethyl-6-(4-methyl-1H-isoindol-5-yl)pyrimidin-2-amine;4-ethyl-6-(6-methyl-1H-isoindol-5-yl)pyrimidin-2-amine;4-ethyl-6-(2-methylphenyl)pyrimidin-2-amine;4-ethyl-6-(3-methylphenyl)pyrimidin-2-amine
• PubChem CID: 161384477
• Molecular Formula: C102H107ClN26O3S
• Molecular Weight: 1812.68 g/mol
• Exact Mass: 1810.84
• IUPAC Name: [4-(2-amino-6-ethylpyrimidin-4-yl)phenyl]methanol;6-[1-(4-chlorophenyl)sulfonylindol-3-yl]-4-N-methylpyrimidine-2,4-diamine;4-ethyl-6-(1H-isoindol-5-yl)pyrimidin-2-amine;4-ethyl-6-(4-methyl-1H-isoindol-5-yl)pyrimidin-2-amine;4-ethyl-6-(6-methyl-1H-isoindol-5-yl)pyrimidin-2-amine;4-ethyl-6-(2-methylphenyl)pyrimidin-2-amine;4-ethyl-6-(3-methylphenyl)pyrimidin-2-amine
• SMILES: CCc1cc(-c2cc3c(cc2C)CN=C3)nc(N)n1.CCc1cc(-c2ccc(CO)cc2)nc(N)n1.CCc1cc(-c2ccc3c(c2)C=NC3)nc(N)n1.CCc1cc(-c2ccc3c(c2C)C=NC3)nc(N)n1.CCc1cc(-c2cccc(C)c2)nc(N)n1.CCc1cc(-c2ccccc2C)nc(N)n1.CNc1cc(-c2cn(S(=O)(=O)c3ccc(Cl)cc3)c3ccccc23)nc(N)n1
• InChI: InChI=1S/C19H16ClN5O2S.2C15H16N4.C14H14N4.C13H15N3O.2C13H15N3/c1-22-18-10-16(23-19(21)24-18)15-11-25(17-5-3-2-4-14(15)17)28(26,27)13-8-6-12(20)7-9-13;1-3-12-6-14(19-15(16)18-12)13-5-11-8-17-7-10(11)4-9(13)2;1-3-11-6-14(19-15(16)18-11)12-5-4-10-7-17-8-13(10)9(12)2;1-2-12-6-13(18-14(15)17-12)9-3-4-10-7-16-8-11(10)5-9;1-2-11-7-12(16-13(14)15-11)10-5-3-9(8-17)4-6-10;1-3-11-8-12(16-13(14)15-11)10-6-4-5-9(2)7-10;1-3-10-8-12(16-13(14)15-10)11-7-5-4-6-9(11)2/h2-11H,1H3,(H3,21,22,23,24);2*4-6,8H,3,7H2,1-2H3,(H2,16,18,19);3-6,8H,2,7H2,1H3,(H2,15,17,18);3-7,17H,2,8H2,1H3,(H2,14,15,16);2*4-8H,3H2,1-2H3,(H2,14,15,16)
• InChIKey: VSDPYABHHDKYRG-UHFFFAOYSA-N
• XLogP: 17.87
• TPSA: 471.01 Ų
• H-Bond Donors: 9
• H-Bond Acceptors: 29
• Rotatable Bonds: 17
• Heavy Atoms: 133
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1812.68
LogP ≤ 5	17.87
H-Bond Donors ≤ 5	9
H-Bond Acceptors ≤ 10	29

Frequently Asked Questions

What is the IUPAC name of [4-(2-amino-6-ethylpyrimidin-4-yl)phenyl]methanol;6-[1-(4-chlorophenyl)sulfonylindol-3-yl]-4-N-methylpyrimidine-2,4-diamine;4-ethyl-6-(1H-isoindol-5-yl)pyrimidin-2-amine;4-ethyl-6-(4-methyl-1H-isoindol-5-yl)pyrimidin-2-amine;4-ethyl-6-(6-methyl-1H-isoindol-5-yl)pyrimidin-2-amine;4-ethyl-6-(2-methylphenyl)pyrimidin-2-amine;4-ethyl-6-(3-methylphenyl)pyrimidin-2-amine?

The IUPAC name of [4-(2-amino-6-ethylpyrimidin-4-yl)phenyl]methanol;6-[1-(4-chlorophenyl)sulfonylindol-3-yl]-4-N-methylpyrimidine-2,4-diamine;4-ethyl-6-(1H-isoindol-5-yl)pyrimidin-2-amine;4-ethyl-6-(4-methyl-1H-isoindol-5-yl)pyrimidin-2-amine;4-ethyl-6-(6-methyl-1H-isoindol-5-yl)pyrimidin-2-amine;4-ethyl-6-(2-methylphenyl)pyrimidin-2-amine;4-ethyl-6-(3-methylphenyl)pyrimidin-2-amine (CID 161384477) is [4-(2-amino-6-ethylpyrimidin-4-yl)phenyl]methanol;6-[1-(4-chlorophenyl)sulfonylindol-3-yl]-4-N-methylpyrimidine-2,4-diamine;4-ethyl-6-(1H-isoindol-5-yl)pyrimidin-2-amine;4-ethyl-6-(4-methyl-1H-isoindol-5-yl)pyrimidin-2-amine;4-ethyl-6-(6-methyl-1H-isoindol-5-yl)pyrimidin-2-amine;4-ethyl-6-(2-methylphenyl)pyrimidin-2-amine;4-ethyl-6-(3-methylphenyl)pyrimidin-2-amine.

What is the SMILES notation for [4-(2-amino-6-ethylpyrimidin-4-yl)phenyl]methanol;6-[1-(4-chlorophenyl)sulfonylindol-3-yl]-4-N-methylpyrimidine-2,4-diamine;4-ethyl-6-(1H-isoindol-5-yl)pyrimidin-2-amine;4-ethyl-6-(4-methyl-1H-isoindol-5-yl)pyrimidin-2-amine;4-ethyl-6-(6-methyl-1H-isoindol-5-yl)pyrimidin-2-amine;4-ethyl-6-(2-methylphenyl)pyrimidin-2-amine;4-ethyl-6-(3-methylphenyl)pyrimidin-2-amine?

The canonical SMILES for [4-(2-amino-6-ethylpyrimidin-4-yl)phenyl]methanol;6-[1-(4-chlorophenyl)sulfonylindol-3-yl]-4-N-methylpyrimidine-2,4-diamine;4-ethyl-6-(1H-isoindol-5-yl)pyrimidin-2-amine;4-ethyl-6-(4-methyl-1H-isoindol-5-yl)pyrimidin-2-amine;4-ethyl-6-(6-methyl-1H-isoindol-5-yl)pyrimidin-2-amine;4-ethyl-6-(2-methylphenyl)pyrimidin-2-amine;4-ethyl-6-(3-methylphenyl)pyrimidin-2-amine is CCc1cc(-c2cc3c(cc2C)CN=C3)nc(N)n1.CCc1cc(-c2ccc(CO)cc2)nc(N)n1.CCc1cc(-c2ccc3c(c2)C=NC3)nc(N)n1.CCc1cc(-c2ccc3c(c2C)C=NC3)nc(N)n1.CCc1cc(-c2cccc(C)c2)nc(N)n1.CCc1cc(-c2ccccc2C)nc(N)n1.CNc1cc(-c2cn(S(=O)(=O)c3ccc(Cl)cc3)c3ccccc23)nc(N)n1.

What is the InChIKey of [4-(2-amino-6-ethylpyrimidin-4-yl)phenyl]methanol;6-[1-(4-chlorophenyl)sulfonylindol-3-yl]-4-N-methylpyrimidine-2,4-diamine;4-ethyl-6-(1H-isoindol-5-yl)pyrimidin-2-amine;4-ethyl-6-(4-methyl-1H-isoindol-5-yl)pyrimidin-2-amine;4-ethyl-6-(6-methyl-1H-isoindol-5-yl)pyrimidin-2-amine;4-ethyl-6-(2-methylphenyl)pyrimidin-2-amine;4-ethyl-6-(3-methylphenyl)pyrimidin-2-amine?

The InChIKey is VSDPYABHHDKYRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16ClN5O2S.2C15H16N4.C14H14N4.C13H15N3O.2C13H15N3/c1-22-18-10-16(23-19(21)24-18)15-11-25(17-5-3-2-4-14(15)17)28(26,27)13-8-6-12(20)7-9-13;1-3-12-6-14(19-15(16)18-12)13-5-11-8-17-7-10(11)4-9(13)2;1-3-11-6-14(19-15(16)18-11)12-5-4-10-7-17-8-13(10)9(12)2;1-2-12-6-13(18-14(15)17-12)9-3-4-10-7-16-8-11(10)5-9;1-2-11-7-12(16-13(14)15-11)10-5-3-9(8-17)4-6-10;1-3-11-8-12(16-13(14)15-11)10-6-4-5-9(2)7-10;1-3-10-8-12(16-13(14)15-10)11-7-5-4-6-9(11)2/h2-11H,1H3,(H3,21,22,23,24);2*4-6,8H,3,7H2,1-2H3,(H2,16,18,19);3-6,8H,2,7H2,1H3,(H2,15,17,18);3-7,17H,2,8H2,1H3,(H2,14,15,16);2*4-8H,3H2,1-2H3,(H2,14,15,16).

What are the key properties of [4-(2-amino-6-ethylpyrimidin-4-yl)phenyl]methanol;6-[1-(4-chlorophenyl)sulfonylindol-3-yl]-4-N-methylpyrimidine-2,4-diamine;4-ethyl-6-(1H-isoindol-5-yl)pyrimidin-2-amine;4-ethyl-6-(4-methyl-1H-isoindol-5-yl)pyrimidin-2-amine;4-ethyl-6-(6-methyl-1H-isoindol-5-yl)pyrimidin-2-amine;4-ethyl-6-(2-methylphenyl)pyrimidin-2-amine;4-ethyl-6-(3-methylphenyl)pyrimidin-2-amine?

[4-(2-amino-6-ethylpyrimidin-4-yl)phenyl]methanol;6-[1-(4-chlorophenyl)sulfonylindol-3-yl]-4-N-methylpyrimidine-2,4-diamine;4-ethyl-6-(1H-isoindol-5-yl)pyrimidin-2-amine;4-ethyl-6-(4-methyl-1H-isoindol-5-yl)pyrimidin-2-amine;4-ethyl-6-(6-methyl-1H-isoindol-5-yl)pyrimidin-2-amine;4-ethyl-6-(2-methylphenyl)pyrimidin-2-amine;4-ethyl-6-(3-methylphenyl)pyrimidin-2-amine has a molecular weight of 1812.68 g/mol, XLogP of 17.87, 17 rotatable bonds, 9 hydrogen bond donors, and 29 hydrogen bond acceptors.

Where does this data come from?

All data for [4-(2-amino-6-ethylpyrimidin-4-yl)phenyl]methanol;6-[1-(4-chlorophenyl)sulfonylindol-3-yl]-4-N-methylpyrimidine-2,4-diamine;4-ethyl-6-(1H-isoindol-5-yl)pyrimidin-2-amine;4-ethyl-6-(4-methyl-1H-isoindol-5-yl)pyrimidin-2-amine;4-ethyl-6-(6-methyl-1H-isoindol-5-yl)pyrimidin-2-amine;4-ethyl-6-(2-methylphenyl)pyrimidin-2-amine;4-ethyl-6-(3-methylphenyl)pyrimidin-2-amine is sourced from PubChem (CID 161384477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).