[5-(2-amino-6-ethylpyrimidin-4-yl)-2-pyridinyl]methanol;4-(3-chloro-4-pyridinyl)-6-ethylpyrimidin-2-amine;4-(cyclobutylmethyl)-6-(2,3-dimethylphenyl)pyrimidin-2-amine;4-N-cyclobutyl-6-[1-(4-methylphenyl)sulfonylindol-3-yl]pyrimidine-2,4-diamine;4-ethyl-6-(1H-inden-5-yl)pyrimidin-2-amine;4-ethyl-6-(3-methylphenyl)pyrimidin-2-amine

C91H99ClN22O3S — CID 158107883

IUPAC[5-(2-amino-6-ethylpyrimidin-4-yl)-2-pyridinyl]methanol;4-(3-chloro-4-pyridinyl)-6-ethylpyrimidin-2-amine;4-(cyclobutylmethyl)-6-(2,3-dimethylphenyl)pyrimidin-2-amine;4-N-cyclobutyl-6-[1-(4-methylphenyl)sulfonylindol-3-yl]pyrimidine-2,4-diamine;4-ethyl-6-(1H-inden-5-yl)pyrimidin-2-amine;4-ethyl-6-(3-methylphenyl)pyrimidin-2-amine
SMILESCCc1cc(-c2ccc(CO)nc2)nc(N)n1.CCc1cc(-c2ccc3c(c2)C=CC3)nc(N)n1.CCc1cc(-c2cccc(C)c2)nc(N)n1.CCc1cc(-c2ccncc2Cl)nc(N)n1.Cc1ccc(S(=O)(=O)n2cc(-c3cc(NC4CCC4)nc(N)n3)c3ccccc32)cc1.Cc1cccc(-c2cc(CC3CCC3)nc(N)n2)c1C
InChIInChI=1S/C23H23N5O2S.C17H21N3.C15H15N3.C13H15N3.C12H14N4O.C11H11ClN4/c1-15-9-11-17(12-10-15)31(29,30)28-14-19(18-7-2-3-8-21(18)28)20-13-22(27-23(24)26-20)25-16-5-4-6-16;1-11-5-3-8-15(12(11)2)16-10-14(19-17(18)20-16)9-13-6-4-7-13;1-2-13-9-14(18-15(16)17-13)12-7-6-10-4-3-5-11(10)8-12;1-3-11-8-12(16-13(14)15-11)10-6-4-5-9(2)7-10;1-2-9-5-11(16-12(13)15-9)8-3-4-10(7-17)14-6-8;1-2-7-5-10(16-11(13)15-7)8-3-4-14-6-9(8)12/h2-3,7-14,16H,4-6H2,1H3,(H3,24,25,26,27);3,5,8,10,13H,4,6-7,9H2,1-2H3,(H2,18,19,20);3,5-9H,2,4H2,1H3,(H2,16,17,18);4-8H,3H2,1-2H3,(H2,14,15,16);3-6,17H,2,7H2,1H3,(H2,13,15,16);3-6H,2H2,1H3,(H2,13,15,16)
InChIKeyFQBHFHIXQHHFNO-UHFFFAOYSA-N
MW1616.46 g/mol
LogP16.84
Rot. Bonds17

About [5-(2-amino-6-ethylpyrimidin-4-yl)-2-pyridinyl]methanol;4-(3-chloro-4-pyridinyl)-6-ethylpyrimidin-2-amine;4-(cyclobutylmethyl)-6-(2,3-dimethylphenyl)pyrimidin-2-amine;4-N-cyclobutyl-6-[1-(4-methylphenyl)sulfonylindol-3-yl]pyrimidine-2,4-diamine;4-ethyl-6-(1H-inden-5-yl)pyrimidin-2-amine;4-ethyl-6-(3-methylphenyl)pyrimidin-2-amine

[5-(2-amino-6-ethylpyrimidin-4-yl)-2-pyridinyl]methanol;4-(3-chloro-4-pyridinyl)-6-ethylpyrimidin-2-amine;4-(cyclobutylmethyl)-6-(2,3-dimethylphenyl)pyrimidin-2-amine;4-N-cyclobutyl-6-[1-(4-methylphenyl)sulfonylindol-3-yl]pyrimidine-2,4-diamine;4-ethyl-6-(1H-inden-5-yl)pyrimidin-2-amine;4-ethyl-6-(3-methylphenyl)pyrimidin-2-amine (PubChem CID 158107883) has the molecular formula C91H99ClN22O3S and a molecular weight of 1616.46 g/mol. Its IUPAC name is [5-(2-amino-6-ethylpyrimidin-4-yl)-2-pyridinyl]methanol;4-(3-chloro-4-pyridinyl)-6-ethylpyrimidin-2-amine;4-(cyclobutylmethyl)-6-(2,3-dimethylphenyl)pyrimidin-2-amine;4-N-cyclobutyl-6-[1-(4-methylphenyl)sulfonylindol-3-yl]pyrimidine-2,4-diamine;4-ethyl-6-(1H-inden-5-yl)pyrimidin-2-amine;4-ethyl-6-(3-methylphenyl)pyrimidin-2-amine.

Molecular Properties

Compound Name[5-(2-amino-6-ethylpyrimidin-4-yl)-2-pyridinyl]methanol;4-(3-chloro-4-pyridinyl)-6-ethylpyrimidin-2-amine;4-(cyclobutylmethyl)-6-(2,3-dimethylphenyl)pyrimidin-2-amine;4-N-cyclobutyl-6-[1-(4-methylphenyl)sulfonylindol-3-yl]pyrimidine-2,4-diamine;4-ethyl-6-(1H-inden-5-yl)pyrimidin-2-amine;4-ethyl-6-(3-methylphenyl)pyrimidin-2-amine
PubChem CID158107883
Molecular FormulaC91H99ClN22O3S
Molecular Weight1616.46 g/mol
Exact Mass1614.77
IUPAC Name[5-(2-amino-6-ethylpyrimidin-4-yl)-2-pyridinyl]methanol;4-(3-chloro-4-pyridinyl)-6-ethylpyrimidin-2-amine;4-(cyclobutylmethyl)-6-(2,3-dimethylphenyl)pyrimidin-2-amine;4-N-cyclobutyl-6-[1-(4-methylphenyl)sulfonylindol-3-yl]pyrimidine-2,4-diamine;4-ethyl-6-(1H-inden-5-yl)pyrimidin-2-amine;4-ethyl-6-(3-methylphenyl)pyrimidin-2-amine
SMILESCCc1cc(-c2ccc(CO)nc2)nc(N)n1.CCc1cc(-c2ccc3c(c2)C=CC3)nc(N)n1.CCc1cc(-c2cccc(C)c2)nc(N)n1.CCc1cc(-c2ccncc2Cl)nc(N)n1.Cc1ccc(S(=O)(=O)n2cc(-c3cc(NC4CCC4)nc(N)n3)c3ccccc32)cc1.Cc1cccc(-c2cc(CC3CCC3)nc(N)n2)c1C
InChIInChI=1S/C23H23N5O2S.C17H21N3.C15H15N3.C13H15N3.C12H14N4O.C11H11ClN4/c1-15-9-11-17(12-10-15)31(29,30)28-14-19(18-7-2-3-8-21(18)28)20-13-22(27-23(24)26-20)25-16-5-4-6-16;1-11-5-3-8-15(12(11)2)16-10-14(19-17(18)20-16)9-13-6-4-7-13;1-2-13-9-14(18-15(16)17-13)12-7-6-10-4-3-5-11(10)8-12;1-3-11-8-12(16-13(14)15-11)10-6-4-5-9(2)7-10;1-2-9-5-11(16-12(13)15-9)8-3-4-10(7-17)14-6-8;1-2-7-5-10(16-11(13)15-7)8-3-4-14-6-9(8)12/h2-3,7-14,16H,4-6H2,1H3,(H3,24,25,26,27);3,5,8,10,13H,4,6-7,9H2,1-2H3,(H2,18,19,20);3,5-9H,2,4H2,1H3,(H2,16,17,18);4-8H,3H2,1-2H3,(H2,14,15,16);3-6,17H,2,7H2,1H3,(H2,13,15,16);3-6H,2H2,1H3,(H2,13,15,16)
InChIKeyFQBHFHIXQHHFNO-UHFFFAOYSA-N
XLogP16.84
TPSA407.91 Ų
H-Bond Donors8
H-Bond Acceptors25
Rotatable Bonds17
Heavy Atoms118
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001616.46
LogP ≤ 516.84
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1025

Analyze [5-(2-amino-6-ethylpyrimidin-4-yl)-2-pyridinyl]methanol;4-(3-chloro-4-pyridinyl)-6-ethylpyrimidin-2-amine;4-(cyclobutylmethyl)-6-(2,3-dimethylphenyl)pyrimidin-2-amine;4-N-cyclobutyl-6-[1-(4-methylphenyl)sulfonylindol-3-yl]pyrimidine-2,4-diamine;4-ethyl-6-(1H-inden-5-yl)pyrimidin-2-amine;4-ethyl-6-(3-methylphenyl)pyrimidin-2-amine with MolForge

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Related Compounds

US11292786, Example 16
CID 146306092
[5-(2-amino-6-ethylpyrimidin-4-yl)-2-pyridinyl]methanol;4-(3-chloro-4-pyridinyl)-6-ethylpyrimidin-2-amine;6-ethyl-4-(1H-inden-5-yl)pyridin-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-(3-methylphenyl)pyrimidin-2-amine
CID 157726513
4-(2-amino-6-ethylpyrimidin-4-yl)phenol;[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-(4-methyl-1H-isoindol-5-yl)pyrimidin-2-amine;4-ethyl-6-(2-methylphenyl)pyrimidin-2-amine
CID 157858533
[4-(2-amino-6-ethylpyrimidin-4-yl)phenyl]methanol;5-(2-amino-6-ethylpyrimidin-4-yl)-1H-pyridin-2-one;6-[1-(4-chlorophenyl)sulfonylindol-3-yl]-4-N-methylpyrimidine-2,4-diamine;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
CID 158543073
[5-(2-amino-6-ethylpyrimidin-4-yl)-2-pyridinyl]methanol;4-(3-chloro-4-pyridinyl)-6-ethylpyrimidin-2-amine;4-(cyclobutylmethyl)-6-(2,3-dimethylphenyl)pyrimidin-2-amine;4-N-cyclobutyl-6-[1-(4-methylphenyl)sulfonylindol-3-yl]pyrimidine-2,4-diamine;4-(cyclopentylmethyl)-6-(2,3-dimethylphenyl)pyrimidin-2-amine;4-N-cyclopentyl-6-[1-(4-methylphenyl)sulfonylindol-3-yl]pyrimidine-2,4-diamine
CID 158751059
[4-(2-amino-6-ethylpyrimidin-4-yl)phenyl]methanol;5-(2-amino-6-ethylpyrimidin-4-yl)-1H-pyridin-2-one;6-[1-(4-chlorophenyl)sulfonylindol-3-yl]-4-N-methylpyrimidine-2,4-diamine;4-ethyl-6-(3-methanimidoyl-2,4-dimethylphenyl)pyrimidin-2-amine;4-ethyl-6-(5-methanimidoyl-2,4-dimethylphenyl)pyrimidin-2-amine;4-ethyl-6-(2-methylphenyl)pyrimidin-2-amine
CID 159151705
[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
[4-(2-amino-6-ethylpyrimidin-4-yl)phenyl]methanol;5-(2-amino-6-ethylpyrimidin-4-yl)-1H-pyridin-2-one;6-[1-(4-chlorophenyl)sulfonylindol-3-yl]-4-N-methylpyrimidine-2,4-diamine;4-ethyl-6-(4-methyl-1H-isoindol-5-yl)pyrimidin-2-amine;4-ethyl-6-(2-methylphenyl)pyrimidin-2-amine
CID 161439212
[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-inden-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 162231143
[3-[5-chloro-2-[3-cyclopropyl-5-[[(3S,5R)-3,5-dimethylpiperazin-1-yl]methyl]anilino]pyrimidin-4-yl]-1-(2-methylphenyl)sulfonylindol-6-yl]methanol
CID 175114853

Frequently Asked Questions

What is the IUPAC name of [5-(2-amino-6-ethylpyrimidin-4-yl)-2-pyridinyl]methanol;4-(3-chloro-4-pyridinyl)-6-ethylpyrimidin-2-amine;4-(cyclobutylmethyl)-6-(2,3-dimethylphenyl)pyrimidin-2-amine;4-N-cyclobutyl-6-[1-(4-methylphenyl)sulfonylindol-3-yl]pyrimidine-2,4-diamine;4-ethyl-6-(1H-inden-5-yl)pyrimidin-2-amine;4-ethyl-6-(3-methylphenyl)pyrimidin-2-amine?
The IUPAC name of [5-(2-amino-6-ethylpyrimidin-4-yl)-2-pyridinyl]methanol;4-(3-chloro-4-pyridinyl)-6-ethylpyrimidin-2-amine;4-(cyclobutylmethyl)-6-(2,3-dimethylphenyl)pyrimidin-2-amine;4-N-cyclobutyl-6-[1-(4-methylphenyl)sulfonylindol-3-yl]pyrimidine-2,4-diamine;4-ethyl-6-(1H-inden-5-yl)pyrimidin-2-amine;4-ethyl-6-(3-methylphenyl)pyrimidin-2-amine (CID 158107883) is [5-(2-amino-6-ethylpyrimidin-4-yl)-2-pyridinyl]methanol;4-(3-chloro-4-pyridinyl)-6-ethylpyrimidin-2-amine;4-(cyclobutylmethyl)-6-(2,3-dimethylphenyl)pyrimidin-2-amine;4-N-cyclobutyl-6-[1-(4-methylphenyl)sulfonylindol-3-yl]pyrimidine-2,4-diamine;4-ethyl-6-(1H-inden-5-yl)pyrimidin-2-amine;4-ethyl-6-(3-methylphenyl)pyrimidin-2-amine.
What is the SMILES notation for [5-(2-amino-6-ethylpyrimidin-4-yl)-2-pyridinyl]methanol;4-(3-chloro-4-pyridinyl)-6-ethylpyrimidin-2-amine;4-(cyclobutylmethyl)-6-(2,3-dimethylphenyl)pyrimidin-2-amine;4-N-cyclobutyl-6-[1-(4-methylphenyl)sulfonylindol-3-yl]pyrimidine-2,4-diamine;4-ethyl-6-(1H-inden-5-yl)pyrimidin-2-amine;4-ethyl-6-(3-methylphenyl)pyrimidin-2-amine?
The canonical SMILES for [5-(2-amino-6-ethylpyrimidin-4-yl)-2-pyridinyl]methanol;4-(3-chloro-4-pyridinyl)-6-ethylpyrimidin-2-amine;4-(cyclobutylmethyl)-6-(2,3-dimethylphenyl)pyrimidin-2-amine;4-N-cyclobutyl-6-[1-(4-methylphenyl)sulfonylindol-3-yl]pyrimidine-2,4-diamine;4-ethyl-6-(1H-inden-5-yl)pyrimidin-2-amine;4-ethyl-6-(3-methylphenyl)pyrimidin-2-amine is CCc1cc(-c2ccc(CO)nc2)nc(N)n1.CCc1cc(-c2ccc3c(c2)C=CC3)nc(N)n1.CCc1cc(-c2cccc(C)c2)nc(N)n1.CCc1cc(-c2ccncc2Cl)nc(N)n1.Cc1ccc(S(=O)(=O)n2cc(-c3cc(NC4CCC4)nc(N)n3)c3ccccc32)cc1.Cc1cccc(-c2cc(CC3CCC3)nc(N)n2)c1C.
What is the InChIKey of [5-(2-amino-6-ethylpyrimidin-4-yl)-2-pyridinyl]methanol;4-(3-chloro-4-pyridinyl)-6-ethylpyrimidin-2-amine;4-(cyclobutylmethyl)-6-(2,3-dimethylphenyl)pyrimidin-2-amine;4-N-cyclobutyl-6-[1-(4-methylphenyl)sulfonylindol-3-yl]pyrimidine-2,4-diamine;4-ethyl-6-(1H-inden-5-yl)pyrimidin-2-amine;4-ethyl-6-(3-methylphenyl)pyrimidin-2-amine?
The InChIKey is FQBHFHIXQHHFNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23N5O2S.C17H21N3.C15H15N3.C13H15N3.C12H14N4O.C11H11ClN4/c1-15-9-11-17(12-10-15)31(29,30)28-14-19(18-7-2-3-8-21(18)28)20-13-22(27-23(24)26-20)25-16-5-4-6-16;1-11-5-3-8-15(12(11)2)16-10-14(19-17(18)20-16)9-13-6-4-7-13;1-2-13-9-14(18-15(16)17-13)12-7-6-10-4-3-5-11(10)8-12;1-3-11-8-12(16-13(14)15-11)10-6-4-5-9(2)7-10;1-2-9-5-11(16-12(13)15-9)8-3-4-10(7-17)14-6-8;1-2-7-5-10(16-11(13)15-7)8-3-4-14-6-9(8)12/h2-3,7-14,16H,4-6H2,1H3,(H3,24,25,26,27);3,5,8,10,13H,4,6-7,9H2,1-2H3,(H2,18,19,20);3,5-9H,2,4H2,1H3,(H2,16,17,18);4-8H,3H2,1-2H3,(H2,14,15,16);3-6,17H,2,7H2,1H3,(H2,13,15,16);3-6H,2H2,1H3,(H2,13,15,16).
What are the key properties of [5-(2-amino-6-ethylpyrimidin-4-yl)-2-pyridinyl]methanol;4-(3-chloro-4-pyridinyl)-6-ethylpyrimidin-2-amine;4-(cyclobutylmethyl)-6-(2,3-dimethylphenyl)pyrimidin-2-amine;4-N-cyclobutyl-6-[1-(4-methylphenyl)sulfonylindol-3-yl]pyrimidine-2,4-diamine;4-ethyl-6-(1H-inden-5-yl)pyrimidin-2-amine;4-ethyl-6-(3-methylphenyl)pyrimidin-2-amine?
[5-(2-amino-6-ethylpyrimidin-4-yl)-2-pyridinyl]methanol;4-(3-chloro-4-pyridinyl)-6-ethylpyrimidin-2-amine;4-(cyclobutylmethyl)-6-(2,3-dimethylphenyl)pyrimidin-2-amine;4-N-cyclobutyl-6-[1-(4-methylphenyl)sulfonylindol-3-yl]pyrimidine-2,4-diamine;4-ethyl-6-(1H-inden-5-yl)pyrimidin-2-amine;4-ethyl-6-(3-methylphenyl)pyrimidin-2-amine has a molecular weight of 1616.46 g/mol, XLogP of 16.84, 17 rotatable bonds, 8 hydrogen bond donors, and 25 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(2-amino-6-ethylpyrimidin-4-yl)-2-pyridinyl]methanol;4-(3-chloro-4-pyridinyl)-6-ethylpyrimidin-2-amine;4-(cyclobutylmethyl)-6-(2,3-dimethylphenyl)pyrimidin-2-amine;4-N-cyclobutyl-6-[1-(4-methylphenyl)sulfonylindol-3-yl]pyrimidine-2,4-diamine;4-ethyl-6-(1H-inden-5-yl)pyrimidin-2-amine;4-ethyl-6-(3-methylphenyl)pyrimidin-2-amine is sourced from PubChem (CID 158107883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).