2-[(2,4-dimethoxyphenyl)iminomethyl]-6-methylphenol;2-[(3,5-dimethoxyphenyl)iminomethyl]-6-methylphenol;2-[(4,6-dimethoxy-1,3,5-triazin-2-yl)iminomethyl]-6-methylphenol;2-[(4,6-dimethyl-1,3,5-triazin-2-yl)iminomethyl]-6-methylphenol;2-(isoquinolin-8-yliminomethyl)-6-methylphenol;2-[(4-methoxyphenyl)iminomethyl]-6-methylphenol;2-methyl-6-(pyridin-2-yliminomethyl)phenol;2-methyl-6-(pyridin-3-yliminomethyl)phenol;2-methyl-6-(pyridin-4-yliminomethyl)phenol;2-methyl-6-(pyrimidin-2-yliminomethyl)phenol;2-methyl-6-(pyrimidin-4-yliminomethyl)phenol;2-methyl-6-(quinolin-8-yliminomethyl)phenol;2-methyl-6-(1,3,5-triazin-2-yliminomethyl)phenol;2-(phenyliminomethyl)-3,5-bis(trifluoromethyl)phenol

C196H182F6N32O21 — CID 159448799

IUPAC2-[(2,4-dimethoxyphenyl)iminomethyl]-6-methylphenol;2-[(3,5-dimethoxyphenyl)iminomethyl]-6-methylphenol;2-[(4,6-dimethoxy-1,3,5-triazin-2-yl)iminomethyl]-6-methylphenol;2-[(4,6-dimethyl-1,3,5-triazin-2-yl)iminomethyl]-6-methylphenol;2-(isoquinolin-8-yliminomethyl)-6-methylphenol;2-[(4-methoxyphenyl)iminomethyl]-6-methylphenol;2-methyl-6-(pyridin-2-yliminomethyl)phenol;2-methyl-6-(pyridin-3-yliminomethyl)phenol;2-methyl-6-(pyridin-4-yliminomethyl)phenol;2-methyl-6-(pyrimidin-2-yliminomethyl)phenol;2-methyl-6-(pyrimidin-4-yliminomethyl)phenol;2-methyl-6-(quinolin-8-yliminomethyl)phenol;2-methyl-6-(1,3,5-triazin-2-yliminomethyl)phenol;2-(phenyliminomethyl)-3,5-bis(trifluoromethyl)phenol
SMILESCOc1cc(/N=C/c2cccc(C)c2O)cc(OC)c1.COc1ccc(/N=C/c2cccc(C)c2O)c(OC)c1.COc1ccc(/N=C/c2cccc(C)c2O)cc1.COc1nc(N=Cc2cccc(C)c2O)nc(OC)n1.Cc1cccc(/C=N/c2cccc3cccnc23)c1O.Cc1cccc(/C=N/c2cccc3ccncc23)c1O.Cc1cccc(/C=N/c2cccnc2)c1O.Cc1cccc(/C=N/c2ccncc2)c1O.Cc1cccc(/C=N/c2ccncn2)c1O.Cc1cccc(C=Nc2ccccn2)c1O.Cc1cccc(C=Nc2ncccn2)c1O.Cc1cccc(C=Nc2ncncn2)c1O.Cc1nc(C)nc(N=Cc2cccc(C)c2O)n1.Oc1cc(C(F)(F)F)cc(C(F)(F)F)c1/C=N/c1ccccc1
InChIInChI=1S/2C17H14N2O.2C16H17NO3.C15H9F6NO.C15H15NO2.C13H14N4O3.C13H14N4O.3C13H12N2O.2C12H11N3O.C11H10N4O/c1-12-5-2-7-14(17(12)20)11-19-15-9-3-6-13-8-4-10-18-16(13)15;1-12-4-2-6-14(17(12)20)10-19-16-7-3-5-13-8-9-18-11-15(13)16;1-11-5-4-6-12(16(11)18)10-17-13-7-14(19-2)9-15(8-13)20-3;1-11-5-4-6-12(16(11)18)10-17-14-8-7-13(19-2)9-15(14)20-3;16-14(17,18)9-6-12(15(19,20)21)11(13(23)7-9)8-22-10-4-2-1-3-5-10;1-11-4-3-5-12(15(11)17)10-16-13-6-8-14(18-2)9-7-13;1-8-5-4-6-9(10(8)18)7-14-11-15-12(19-2)17-13(16-11)20-3;1-8-5-4-6-11(12(8)18)7-14-13-16-9(2)15-10(3)17-13;1-10-4-2-5-11(13(10)16)8-15-12-6-3-7-14-9-12;1-10-5-4-6-11(13(10)16)9-15-12-7-2-3-8-14-12;1-10-3-2-4-11(13(10)16)9-15-12-5-7-14-8-6-12;1-9-4-2-5-10(11(9)16)8-15-12-13-6-3-7-14-12;1-9-3-2-4-10(12(9)16)7-14-11-5-6-13-8-15-11;1-8-3-2-4-9(10(8)16)5-13-11-14-6-12-7-15-11/h2*2-11,20H,1H3;2*4-10,18H,1-3H3;1-8,23H;3-10,17H,1-2H3;4-7,18H,1-3H3;4-7,18H,1-3H3;3*2-9,16H,1H3;2*2-8,16H,1H3;2-7,16H,1H3/b19-11+;19-10+;2*17-10+;22-8+;16-10+;;;15-8+;;15-9+;;14-7+;
InChIKeyLTCFARFCKBBUMP-QDOHNKBWSA-N
MW3435.80 g/mol
LogP42.14
Rot. Bonds35

About 2-[(2,4-dimethoxyphenyl)iminomethyl]-6-methylphenol;2-[(3,5-dimethoxyphenyl)iminomethyl]-6-methylphenol;2-[(4,6-dimethoxy-1,3,5-triazin-2-yl)iminomethyl]-6-methylphenol;2-[(4,6-dimethyl-1,3,5-triazin-2-yl)iminomethyl]-6-methylphenol;2-(isoquinolin-8-yliminomethyl)-6-methylphenol;2-[(4-methoxyphenyl)iminomethyl]-6-methylphenol;2-methyl-6-(pyridin-2-yliminomethyl)phenol;2-methyl-6-(pyridin-3-yliminomethyl)phenol;2-methyl-6-(pyridin-4-yliminomethyl)phenol;2-methyl-6-(pyrimidin-2-yliminomethyl)phenol;2-methyl-6-(pyrimidin-4-yliminomethyl)phenol;2-methyl-6-(quinolin-8-yliminomethyl)phenol;2-methyl-6-(1,3,5-triazin-2-yliminomethyl)phenol;2-(phenyliminomethyl)-3,5-bis(trifluoromethyl)phenol

2-[(2,4-dimethoxyphenyl)iminomethyl]-6-methylphenol;2-[(3,5-dimethoxyphenyl)iminomethyl]-6-methylphenol;2-[(4,6-dimethoxy-1,3,5-triazin-2-yl)iminomethyl]-6-methylphenol;2-[(4,6-dimethyl-1,3,5-triazin-2-yl)iminomethyl]-6-methylphenol;2-(isoquinolin-8-yliminomethyl)-6-methylphenol;2-[(4-methoxyphenyl)iminomethyl]-6-methylphenol;2-methyl-6-(pyridin-2-yliminomethyl)phenol;2-methyl-6-(pyridin-3-yliminomethyl)phenol;2-methyl-6-(pyridin-4-yliminomethyl)phenol;2-methyl-6-(pyrimidin-2-yliminomethyl)phenol;2-methyl-6-(pyrimidin-4-yliminomethyl)phenol;2-methyl-6-(quinolin-8-yliminomethyl)phenol;2-methyl-6-(1,3,5-triazin-2-yliminomethyl)phenol;2-(phenyliminomethyl)-3,5-bis(trifluoromethyl)phenol (PubChem CID 159448799) has the molecular formula C196H182F6N32O21 and a molecular weight of 3435.80 g/mol. Its IUPAC name is 2-[(2,4-dimethoxyphenyl)iminomethyl]-6-methylphenol;2-[(3,5-dimethoxyphenyl)iminomethyl]-6-methylphenol;2-[(4,6-dimethoxy-1,3,5-triazin-2-yl)iminomethyl]-6-methylphenol;2-[(4,6-dimethyl-1,3,5-triazin-2-yl)iminomethyl]-6-methylphenol;2-(isoquinolin-8-yliminomethyl)-6-methylphenol;2-[(4-methoxyphenyl)iminomethyl]-6-methylphenol;2-methyl-6-(pyridin-2-yliminomethyl)phenol;2-methyl-6-(pyridin-3-yliminomethyl)phenol;2-methyl-6-(pyridin-4-yliminomethyl)phenol;2-methyl-6-(pyrimidin-2-yliminomethyl)phenol;2-methyl-6-(pyrimidin-4-yliminomethyl)phenol;2-methyl-6-(quinolin-8-yliminomethyl)phenol;2-methyl-6-(1,3,5-triazin-2-yliminomethyl)phenol;2-(phenyliminomethyl)-3,5-bis(trifluoromethyl)phenol.

Molecular Properties

Compound Name2-[(2,4-dimethoxyphenyl)iminomethyl]-6-methylphenol;2-[(3,5-dimethoxyphenyl)iminomethyl]-6-methylphenol;2-[(4,6-dimethoxy-1,3,5-triazin-2-yl)iminomethyl]-6-methylphenol;2-[(4,6-dimethyl-1,3,5-triazin-2-yl)iminomethyl]-6-methylphenol;2-(isoquinolin-8-yliminomethyl)-6-methylphenol;2-[(4-methoxyphenyl)iminomethyl]-6-methylphenol;2-methyl-6-(pyridin-2-yliminomethyl)phenol;2-methyl-6-(pyridin-3-yliminomethyl)phenol;2-methyl-6-(pyridin-4-yliminomethyl)phenol;2-methyl-6-(pyrimidin-2-yliminomethyl)phenol;2-methyl-6-(pyrimidin-4-yliminomethyl)phenol;2-methyl-6-(quinolin-8-yliminomethyl)phenol;2-methyl-6-(1,3,5-triazin-2-yliminomethyl)phenol;2-(phenyliminomethyl)-3,5-bis(trifluoromethyl)phenol
PubChem CID159448799
Molecular FormulaC196H182F6N32O21
Molecular Weight3435.80 g/mol
Exact Mass3433.41
IUPAC Name2-[(2,4-dimethoxyphenyl)iminomethyl]-6-methylphenol;2-[(3,5-dimethoxyphenyl)iminomethyl]-6-methylphenol;2-[(4,6-dimethoxy-1,3,5-triazin-2-yl)iminomethyl]-6-methylphenol;2-[(4,6-dimethyl-1,3,5-triazin-2-yl)iminomethyl]-6-methylphenol;2-(isoquinolin-8-yliminomethyl)-6-methylphenol;2-[(4-methoxyphenyl)iminomethyl]-6-methylphenol;2-methyl-6-(pyridin-2-yliminomethyl)phenol;2-methyl-6-(pyridin-3-yliminomethyl)phenol;2-methyl-6-(pyridin-4-yliminomethyl)phenol;2-methyl-6-(pyrimidin-2-yliminomethyl)phenol;2-methyl-6-(pyrimidin-4-yliminomethyl)phenol;2-methyl-6-(quinolin-8-yliminomethyl)phenol;2-methyl-6-(1,3,5-triazin-2-yliminomethyl)phenol;2-(phenyliminomethyl)-3,5-bis(trifluoromethyl)phenol
SMILESCOc1cc(/N=C/c2cccc(C)c2O)cc(OC)c1.COc1ccc(/N=C/c2cccc(C)c2O)c(OC)c1.COc1ccc(/N=C/c2cccc(C)c2O)cc1.COc1nc(N=Cc2cccc(C)c2O)nc(OC)n1.Cc1cccc(/C=N/c2cccc3cccnc23)c1O.Cc1cccc(/C=N/c2cccc3ccncc23)c1O.Cc1cccc(/C=N/c2cccnc2)c1O.Cc1cccc(/C=N/c2ccncc2)c1O.Cc1cccc(/C=N/c2ccncn2)c1O.Cc1cccc(C=Nc2ccccn2)c1O.Cc1cccc(C=Nc2ncccn2)c1O.Cc1cccc(C=Nc2ncncn2)c1O.Cc1nc(C)nc(N=Cc2cccc(C)c2O)n1.Oc1cc(C(F)(F)F)cc(C(F)(F)F)c1/C=N/c1ccccc1
InChIInChI=1S/2C17H14N2O.2C16H17NO3.C15H9F6NO.C15H15NO2.C13H14N4O3.C13H14N4O.3C13H12N2O.2C12H11N3O.C11H10N4O/c1-12-5-2-7-14(17(12)20)11-19-15-9-3-6-13-8-4-10-18-16(13)15;1-12-4-2-6-14(17(12)20)10-19-16-7-3-5-13-8-9-18-11-15(13)16;1-11-5-4-6-12(16(11)18)10-17-13-7-14(19-2)9-15(8-13)20-3;1-11-5-4-6-12(16(11)18)10-17-14-8-7-13(19-2)9-15(14)20-3;16-14(17,18)9-6-12(15(19,20)21)11(13(23)7-9)8-22-10-4-2-1-3-5-10;1-11-4-3-5-12(15(11)17)10-16-13-6-8-14(18-2)9-7-13;1-8-5-4-6-9(10(8)18)7-14-11-15-12(19-2)17-13(16-11)20-3;1-8-5-4-6-11(12(8)18)7-14-13-16-9(2)15-10(3)17-13;1-10-4-2-5-11(13(10)16)8-15-12-6-3-7-14-9-12;1-10-5-4-6-11(13(10)16)9-15-12-7-2-3-8-14-12;1-10-3-2-4-11(13(10)16)9-15-12-5-7-14-8-6-12;1-9-4-2-5-10(11(9)16)8-15-12-13-6-3-7-14-12;1-9-3-2-4-10(12(9)16)7-14-11-5-6-13-8-15-11;1-8-3-2-4-9(10(8)16)5-13-11-14-6-12-7-15-11/h2*2-11,20H,1H3;2*4-10,18H,1-3H3;1-8,23H;3-10,17H,1-2H3;4-7,18H,1-3H3;4-7,18H,1-3H3;3*2-9,16H,1H3;2*2-8,16H,1H3;2-7,16H,1H3/b19-11+;19-10+;2*17-10+;22-8+;16-10+;;;15-8+;;15-9+;;14-7+;
InChIKeyLTCFARFCKBBUMP-QDOHNKBWSA-N
XLogP42.14
TPSA752.89 Ų
H-Bond Donors14
H-Bond Acceptors53
Rotatable Bonds35
Heavy Atoms255
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003435.80
LogP ≤ 542.14
H-Bond Donors ≤ 514
H-Bond Acceptors ≤ 1053

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

Analyze 2-[(2,4-dimethoxyphenyl)iminomethyl]-6-methylphenol;2-[(3,5-dimethoxyphenyl)iminomethyl]-6-methylphenol;2-[(4,6-dimethoxy-1,3,5-triazin-2-yl)iminomethyl]-6-methylphenol;2-[(4,6-dimethyl-1,3,5-triazin-2-yl)iminomethyl]-6-methylphenol;2-(isoquinolin-8-yliminomethyl)-6-methylphenol;2-[(4-methoxyphenyl)iminomethyl]-6-methylphenol;2-methyl-6-(pyridin-2-yliminomethyl)phenol;2-methyl-6-(pyridin-3-yliminomethyl)phenol;2-methyl-6-(pyridin-4-yliminomethyl)phenol;2-methyl-6-(pyrimidin-2-yliminomethyl)phenol;2-methyl-6-(pyrimidin-4-yliminomethyl)phenol;2-methyl-6-(quinolin-8-yliminomethyl)phenol;2-methyl-6-(1,3,5-triazin-2-yliminomethyl)phenol;2-(phenyliminomethyl)-3,5-bis(trifluoromethyl)phenol with MolForge

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Related Compounds

N-(1,4-dimethylnaphthalen-2-yl)-5-(trifluoromethyl)pyridin-2-amine;N-[2-methyl-4-(trifluoromethoxy)phenyl]quinoxalin-2-amine;N-pyrazin-2-ylquinolin-3-amine;N-pyridin-3-ylquinolin-3-amine;N-pyridin-4-ylquinolin-3-amine;N-[2-(trifluoromethoxy)phenyl]quinoxalin-2-amine;N-[3-(trifluoromethoxy)phenyl]quinoxalin-2-amine;N-[4-(trifluoromethoxy)phenyl]quinoxalin-2-amine
CID 157465784
5,8-dimethyl-N-[5-(trifluoromethyl)-2-pyridinyl]isoquinolin-6-amine;N-[2-methyl-4-(trifluoromethoxy)phenyl]quinoxalin-2-amine;N-pyrazin-2-ylquinolin-3-amine;N-pyridin-3-ylquinolin-3-amine;N-pyridin-4-ylquinolin-3-amine;N-[2-(trifluoromethoxy)phenyl]quinoxalin-2-amine;N-[3-(trifluoromethoxy)phenyl]quinoxalin-2-amine;N-[4-(trifluoromethoxy)phenyl]quinoxalin-2-amine
CID 157875438
2-(3,5-Dimethoxy-2-methylphenyl)-3-methylbenzo[g]quinazolin-3-ium;3-methyl-2-(2-methylphenyl)benzo[g]quinazolin-3-ium;1-methyl-2-(2-methylphenyl)-7-(trifluoromethyl)benzo[g]quinazolin-1-ium;3-methyl-2-(2,3,5-trimethylphenyl)benzo[g]quinazolin-3-ium
CID 158313754
3,8-Bis(3,4-difluorophenyl)-2,4,7,9-tetrahydro-[1,3]benzoxazino[6,7-g][1,3]benzoxazine;3,8-bis[2-(trifluoromethyl)phenyl]-2,4,7,9-tetrahydro-[1,3]benzoxazino[6,7-g][1,3]benzoxazine;3,10-bis(2,4,6-trifluorophenyl)-2,4,9,11-tetrahydro-[1,3]benzoxazino[7,6-h][1,3]benzoxazine;1,2-difluoro-4-methylbenzene;1,3-difluoro-2-methylbenzene;1,4-difluoro-2-methylbenzene;2,4-difluoro-1-methylbenzene;1-fluoro-4-methylbenzene;10-(3-methylphenyl)-3-[3-(trifluoromethyl)phenyl]-2,4,9,11-tetrahydro-[1,3]benzoxazino[7,6-h][1,3]benzoxazine;2-methylpyridine;3-methylpyridine;4-methylpyridine;2-methylpyrimidine;1-methyl-3-(trifluoromethyl)benzene;toluene;1,3,5-trifluoro-2-methylbenzene
CID 158795075
5,8-dimethyl-N-[5-(trifluoromethyl)-2-pyridinyl]isoquinolin-6-amine;N-[2-methyl-4-(trifluoromethoxy)phenyl]quinoxalin-2-amine;N-pyrazin-2-ylquinoxalin-2-amine;N-pyridin-3-ylquinolin-3-amine;N-pyridin-4-ylquinolin-3-amine;N-[2-(trifluoromethoxy)phenyl]quinoxalin-2-amine;N-[3-(trifluoromethoxy)phenyl]quinoxalin-2-amine;N-[4-(trifluoromethoxy)phenyl]quinoxalin-2-amine
CID 160750272
3-(3,4-Difluorophenyl)-9-methyl-2,4-dihydropyrido[3,2-h][1,3]benzoxazine;3-pyridin-3-yl-2,4-dihydropyrido[3,2-e][1,3]oxazine;bis(3-pyridin-4-yl-2,4-dihydropyrido[3,2-e][1,3]oxazine);3-pyrimidin-2-yl-2,4-dihydropyrido[3,2-e][1,3]oxazine;8-[3-(trifluoromethyl)phenyl]-7,10-dihydropyrido[3,2-h][2,3]benzoxazine
CID 160936724
1-[4-[2-[2-(4-fluoro-4-methylpiperidin-1-yl)ethoxy]-7-(3-hydroxynaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]piperazin-1-yl]prop-2-en-1-one;1-[4-[7-(5-hydroxy-2-methylphenyl)-2-(3-piperidin-1-ylpropoxy)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]piperazin-1-yl]prop-2-en-1-one;1-[4-[7-(3-hydroxynaphthalen-1-yl)-2-[2-[2-methoxyethyl(methyl)amino]ethoxy]-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]piperazin-1-yl]prop-2-en-1-one;1-[4-[7-(3-hydroxynaphthalen-1-yl)-2-[2-(4-methoxypiperidin-1-yl)ethoxy]-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]piperazin-1-yl]prop-2-en-1-one;1-[4-[7-[4-hydroxy-2-(trifluoromethoxy)phenyl]-2-(3-piperidin-1-ylpropoxy)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]piperazin-1-yl]prop-2-en-1-one
CID 163436410
1-[4-[2-[2-(4-fluoro-4-methylpiperidin-1-yl)ethoxy]-7-(3-hydroxynaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]piperazin-1-yl]prop-2-en-1-one;1-[4-[7-(3-hydroxynaphthalen-1-yl)-2-[2-[2-methoxyethyl(methyl)amino]ethoxy]-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]piperazin-1-yl]prop-2-en-1-one;1-[4-[7-(3-hydroxynaphthalen-1-yl)-2-[2-(4-methoxypiperidin-1-yl)ethoxy]-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]piperazin-1-yl]prop-2-en-1-one;1-[4-[7-[4-hydroxy-2-(trifluoromethoxy)phenyl]-2-(3-piperidin-1-ylpropoxy)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]piperazin-1-yl]prop-2-en-1-one
CID 163799135
1-(2,4-dimethoxyphenyl)-3-(2,6-dimethylphenyl)-7-(3-methoxy-4-morpholin-4-ylanilino)-4H-pyrimido[4,5-d]pyrimidin-2-one;1-(2,4-dimethoxyphenyl)-3-(2,6-dimethylphenyl)-7-[[4-[(4-methylpiperazin-1-yl)methyl]phenyl]methyl]-4H-pyrimido[4,5-d]pyrimidin-2-one;1-(2,4-dimethoxyphenyl)-3-(2,6-dimethylphenyl)-7-[3-[(4-methylpiperazin-1-yl)methyl]-5-(trifluoromethyl)anilino]-4H-pyrimido[4,5-d]pyrimidin-2-one;1-(2,4-dimethoxyphenyl)-3-(2,6-dimethylphenyl)-7-[3-(morpholin-4-ylmethyl)-5-(trifluoromethyl)anilino]-4H-pyrimido[4,5-d]pyrimidin-2-one
CID 165065157
3-(3,4-Difluorophenyl)-2,4-dihydropyrido[2,3-e][1,3]oxazine;3-(3,4-difluorophenyl)-2,4-dihydropyrido[3,2-h][1,3]benzoxazine;3-pyridin-3-yl-2,4-dihydropyrido[2,3-e][1,3]oxazine;3-pyridin-3-yl-2,4-dihydropyrido[3,2-e][1,3]oxazine;3-pyridin-4-yl-2,4-dihydropyrido[2,3-e][1,3]oxazine;bis(3-pyridin-4-yl-2,4-dihydropyrido[3,2-e][1,3]oxazine);3-pyridin-4-yl-2,4-dihydropyrido[3,4-e][1,3]oxazine;3-pyrimidin-2-yl-2,4-dihydropyrido[2,3-e][1,3]oxazine;3-pyrimidin-2-yl-2,4-dihydropyrido[3,2-e][1,3]oxazine;3-pyrimidin-2-yl-2,4-dihydropyrido[3,4-e][1,3]oxazine
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3-ethyl-1-propan-2-ylisoquinoline;2-methoxy-1-propan-2-ylnaphthalene;3-methoxy-1-propan-2-ylnaphthalene;2-methylidene-8-propan-2-yl-1H-quinoline;8-methyl-1-propan-2-ylisoquinolin-3-amine;1-methyl-5-propan-2-ylnaphthalene;1-methyl-8-propan-2-ylnaphthalene;6-methyl-1-propan-2-ylnaphthalene;7-methyl-1-propan-2-ylnaphthalene;1-propan-2-ylisoquinolin-3-amine;bis(1-propan-2-ylnaphthalene);1-propan-2-ylnaphthalen-2-ol;bis(4-propan-2-ylnaphthalen-2-ol);4-propan-2-ylquinazolin-2-amine;4-propan-2-ylquinolin-2-amine;8-propan-2-ylquinoline;5-propan-2-ylquinolin-7-ol;8-propan-2-ylquinolin-6-ol;4-propan-2-yl-5,6,7,8-tetrahydronaphthalen-2-ol
CID 157329463
9-Methyl-3-pyridin-2-yl-2,4-dihydropyrido[3,2-h][1,3]benzoxazine;9-methyl-3-pyridin-3-yl-2,4-dihydropyrido[3,2-h][1,3]benzoxazine;9-methyl-3-pyridin-4-yl-2,4-dihydropyrido[3,2-h][1,3]benzoxazine;9-methyl-3-pyrimidin-2-yl-2,4-dihydropyrido[3,2-h][1,3]benzoxazine;3-pyridin-2-yl-2,4-dihydropyrido[4,3-h][1,3]benzoxazine;3-pyridin-3-yl-2,4-dihydropyrido[3,2-h][1,3]benzoxazine;3-pyridin-4-yl-2,4-dihydropyrido[3,2-h][1,3]benzoxazine;3-pyrimidin-2-yl-2,4-dihydropyrido[4,3-h][1,3]benzoxazine
CID 157372697

Frequently Asked Questions

What is the IUPAC name of 2-[(2,4-dimethoxyphenyl)iminomethyl]-6-methylphenol;2-[(3,5-dimethoxyphenyl)iminomethyl]-6-methylphenol;2-[(4,6-dimethoxy-1,3,5-triazin-2-yl)iminomethyl]-6-methylphenol;2-[(4,6-dimethyl-1,3,5-triazin-2-yl)iminomethyl]-6-methylphenol;2-(isoquinolin-8-yliminomethyl)-6-methylphenol;2-[(4-methoxyphenyl)iminomethyl]-6-methylphenol;2-methyl-6-(pyridin-2-yliminomethyl)phenol;2-methyl-6-(pyridin-3-yliminomethyl)phenol;2-methyl-6-(pyridin-4-yliminomethyl)phenol;2-methyl-6-(pyrimidin-2-yliminomethyl)phenol;2-methyl-6-(pyrimidin-4-yliminomethyl)phenol;2-methyl-6-(quinolin-8-yliminomethyl)phenol;2-methyl-6-(1,3,5-triazin-2-yliminomethyl)phenol;2-(phenyliminomethyl)-3,5-bis(trifluoromethyl)phenol?
The IUPAC name of 2-[(2,4-dimethoxyphenyl)iminomethyl]-6-methylphenol;2-[(3,5-dimethoxyphenyl)iminomethyl]-6-methylphenol;2-[(4,6-dimethoxy-1,3,5-triazin-2-yl)iminomethyl]-6-methylphenol;2-[(4,6-dimethyl-1,3,5-triazin-2-yl)iminomethyl]-6-methylphenol;2-(isoquinolin-8-yliminomethyl)-6-methylphenol;2-[(4-methoxyphenyl)iminomethyl]-6-methylphenol;2-methyl-6-(pyridin-2-yliminomethyl)phenol;2-methyl-6-(pyridin-3-yliminomethyl)phenol;2-methyl-6-(pyridin-4-yliminomethyl)phenol;2-methyl-6-(pyrimidin-2-yliminomethyl)phenol;2-methyl-6-(pyrimidin-4-yliminomethyl)phenol;2-methyl-6-(quinolin-8-yliminomethyl)phenol;2-methyl-6-(1,3,5-triazin-2-yliminomethyl)phenol;2-(phenyliminomethyl)-3,5-bis(trifluoromethyl)phenol (CID 159448799) is 2-[(2,4-dimethoxyphenyl)iminomethyl]-6-methylphenol;2-[(3,5-dimethoxyphenyl)iminomethyl]-6-methylphenol;2-[(4,6-dimethoxy-1,3,5-triazin-2-yl)iminomethyl]-6-methylphenol;2-[(4,6-dimethyl-1,3,5-triazin-2-yl)iminomethyl]-6-methylphenol;2-(isoquinolin-8-yliminomethyl)-6-methylphenol;2-[(4-methoxyphenyl)iminomethyl]-6-methylphenol;2-methyl-6-(pyridin-2-yliminomethyl)phenol;2-methyl-6-(pyridin-3-yliminomethyl)phenol;2-methyl-6-(pyridin-4-yliminomethyl)phenol;2-methyl-6-(pyrimidin-2-yliminomethyl)phenol;2-methyl-6-(pyrimidin-4-yliminomethyl)phenol;2-methyl-6-(quinolin-8-yliminomethyl)phenol;2-methyl-6-(1,3,5-triazin-2-yliminomethyl)phenol;2-(phenyliminomethyl)-3,5-bis(trifluoromethyl)phenol.
What is the SMILES notation for 2-[(2,4-dimethoxyphenyl)iminomethyl]-6-methylphenol;2-[(3,5-dimethoxyphenyl)iminomethyl]-6-methylphenol;2-[(4,6-dimethoxy-1,3,5-triazin-2-yl)iminomethyl]-6-methylphenol;2-[(4,6-dimethyl-1,3,5-triazin-2-yl)iminomethyl]-6-methylphenol;2-(isoquinolin-8-yliminomethyl)-6-methylphenol;2-[(4-methoxyphenyl)iminomethyl]-6-methylphenol;2-methyl-6-(pyridin-2-yliminomethyl)phenol;2-methyl-6-(pyridin-3-yliminomethyl)phenol;2-methyl-6-(pyridin-4-yliminomethyl)phenol;2-methyl-6-(pyrimidin-2-yliminomethyl)phenol;2-methyl-6-(pyrimidin-4-yliminomethyl)phenol;2-methyl-6-(quinolin-8-yliminomethyl)phenol;2-methyl-6-(1,3,5-triazin-2-yliminomethyl)phenol;2-(phenyliminomethyl)-3,5-bis(trifluoromethyl)phenol?
The canonical SMILES for 2-[(2,4-dimethoxyphenyl)iminomethyl]-6-methylphenol;2-[(3,5-dimethoxyphenyl)iminomethyl]-6-methylphenol;2-[(4,6-dimethoxy-1,3,5-triazin-2-yl)iminomethyl]-6-methylphenol;2-[(4,6-dimethyl-1,3,5-triazin-2-yl)iminomethyl]-6-methylphenol;2-(isoquinolin-8-yliminomethyl)-6-methylphenol;2-[(4-methoxyphenyl)iminomethyl]-6-methylphenol;2-methyl-6-(pyridin-2-yliminomethyl)phenol;2-methyl-6-(pyridin-3-yliminomethyl)phenol;2-methyl-6-(pyridin-4-yliminomethyl)phenol;2-methyl-6-(pyrimidin-2-yliminomethyl)phenol;2-methyl-6-(pyrimidin-4-yliminomethyl)phenol;2-methyl-6-(quinolin-8-yliminomethyl)phenol;2-methyl-6-(1,3,5-triazin-2-yliminomethyl)phenol;2-(phenyliminomethyl)-3,5-bis(trifluoromethyl)phenol is COc1cc(/N=C/c2cccc(C)c2O)cc(OC)c1.COc1ccc(/N=C/c2cccc(C)c2O)c(OC)c1.COc1ccc(/N=C/c2cccc(C)c2O)cc1.COc1nc(N=Cc2cccc(C)c2O)nc(OC)n1.Cc1cccc(/C=N/c2cccc3cccnc23)c1O.Cc1cccc(/C=N/c2cccc3ccncc23)c1O.Cc1cccc(/C=N/c2cccnc2)c1O.Cc1cccc(/C=N/c2ccncc2)c1O.Cc1cccc(/C=N/c2ccncn2)c1O.Cc1cccc(C=Nc2ccccn2)c1O.Cc1cccc(C=Nc2ncccn2)c1O.Cc1cccc(C=Nc2ncncn2)c1O.Cc1nc(C)nc(N=Cc2cccc(C)c2O)n1.Oc1cc(C(F)(F)F)cc(C(F)(F)F)c1/C=N/c1ccccc1.
What is the InChIKey of 2-[(2,4-dimethoxyphenyl)iminomethyl]-6-methylphenol;2-[(3,5-dimethoxyphenyl)iminomethyl]-6-methylphenol;2-[(4,6-dimethoxy-1,3,5-triazin-2-yl)iminomethyl]-6-methylphenol;2-[(4,6-dimethyl-1,3,5-triazin-2-yl)iminomethyl]-6-methylphenol;2-(isoquinolin-8-yliminomethyl)-6-methylphenol;2-[(4-methoxyphenyl)iminomethyl]-6-methylphenol;2-methyl-6-(pyridin-2-yliminomethyl)phenol;2-methyl-6-(pyridin-3-yliminomethyl)phenol;2-methyl-6-(pyridin-4-yliminomethyl)phenol;2-methyl-6-(pyrimidin-2-yliminomethyl)phenol;2-methyl-6-(pyrimidin-4-yliminomethyl)phenol;2-methyl-6-(quinolin-8-yliminomethyl)phenol;2-methyl-6-(1,3,5-triazin-2-yliminomethyl)phenol;2-(phenyliminomethyl)-3,5-bis(trifluoromethyl)phenol?
The InChIKey is LTCFARFCKBBUMP-QDOHNKBWSA-N. The full InChI is InChI=1S/2C17H14N2O.2C16H17NO3.C15H9F6NO.C15H15NO2.C13H14N4O3.C13H14N4O.3C13H12N2O.2C12H11N3O.C11H10N4O/c1-12-5-2-7-14(17(12)20)11-19-15-9-3-6-13-8-4-10-18-16(13)15;1-12-4-2-6-14(17(12)20)10-19-16-7-3-5-13-8-9-18-11-15(13)16;1-11-5-4-6-12(16(11)18)10-17-13-7-14(19-2)9-15(8-13)20-3;1-11-5-4-6-12(16(11)18)10-17-14-8-7-13(19-2)9-15(14)20-3;16-14(17,18)9-6-12(15(19,20)21)11(13(23)7-9)8-22-10-4-2-1-3-5-10;1-11-4-3-5-12(15(11)17)10-16-13-6-8-14(18-2)9-7-13;1-8-5-4-6-9(10(8)18)7-14-11-15-12(19-2)17-13(16-11)20-3;1-8-5-4-6-11(12(8)18)7-14-13-16-9(2)15-10(3)17-13;1-10-4-2-5-11(13(10)16)8-15-12-6-3-7-14-9-12;1-10-5-4-6-11(13(10)16)9-15-12-7-2-3-8-14-12;1-10-3-2-4-11(13(10)16)9-15-12-5-7-14-8-6-12;1-9-4-2-5-10(11(9)16)8-15-12-13-6-3-7-14-12;1-9-3-2-4-10(12(9)16)7-14-11-5-6-13-8-15-11;1-8-3-2-4-9(10(8)16)5-13-11-14-6-12-7-15-11/h2*2-11,20H,1H3;2*4-10,18H,1-3H3;1-8,23H;3-10,17H,1-2H3;4-7,18H,1-3H3;4-7,18H,1-3H3;3*2-9,16H,1H3;2*2-8,16H,1H3;2-7,16H,1H3/b19-11+;19-10+;2*17-10+;22-8+;16-10+;;;15-8+;;15-9+;;14-7+;.
What are the key properties of 2-[(2,4-dimethoxyphenyl)iminomethyl]-6-methylphenol;2-[(3,5-dimethoxyphenyl)iminomethyl]-6-methylphenol;2-[(4,6-dimethoxy-1,3,5-triazin-2-yl)iminomethyl]-6-methylphenol;2-[(4,6-dimethyl-1,3,5-triazin-2-yl)iminomethyl]-6-methylphenol;2-(isoquinolin-8-yliminomethyl)-6-methylphenol;2-[(4-methoxyphenyl)iminomethyl]-6-methylphenol;2-methyl-6-(pyridin-2-yliminomethyl)phenol;2-methyl-6-(pyridin-3-yliminomethyl)phenol;2-methyl-6-(pyridin-4-yliminomethyl)phenol;2-methyl-6-(pyrimidin-2-yliminomethyl)phenol;2-methyl-6-(pyrimidin-4-yliminomethyl)phenol;2-methyl-6-(quinolin-8-yliminomethyl)phenol;2-methyl-6-(1,3,5-triazin-2-yliminomethyl)phenol;2-(phenyliminomethyl)-3,5-bis(trifluoromethyl)phenol?
2-[(2,4-dimethoxyphenyl)iminomethyl]-6-methylphenol;2-[(3,5-dimethoxyphenyl)iminomethyl]-6-methylphenol;2-[(4,6-dimethoxy-1,3,5-triazin-2-yl)iminomethyl]-6-methylphenol;2-[(4,6-dimethyl-1,3,5-triazin-2-yl)iminomethyl]-6-methylphenol;2-(isoquinolin-8-yliminomethyl)-6-methylphenol;2-[(4-methoxyphenyl)iminomethyl]-6-methylphenol;2-methyl-6-(pyridin-2-yliminomethyl)phenol;2-methyl-6-(pyridin-3-yliminomethyl)phenol;2-methyl-6-(pyridin-4-yliminomethyl)phenol;2-methyl-6-(pyrimidin-2-yliminomethyl)phenol;2-methyl-6-(pyrimidin-4-yliminomethyl)phenol;2-methyl-6-(quinolin-8-yliminomethyl)phenol;2-methyl-6-(1,3,5-triazin-2-yliminomethyl)phenol;2-(phenyliminomethyl)-3,5-bis(trifluoromethyl)phenol has a molecular weight of 3435.80 g/mol, XLogP of 42.14, 35 rotatable bonds, 14 hydrogen bond donors, and 53 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2,4-dimethoxyphenyl)iminomethyl]-6-methylphenol;2-[(3,5-dimethoxyphenyl)iminomethyl]-6-methylphenol;2-[(4,6-dimethoxy-1,3,5-triazin-2-yl)iminomethyl]-6-methylphenol;2-[(4,6-dimethyl-1,3,5-triazin-2-yl)iminomethyl]-6-methylphenol;2-(isoquinolin-8-yliminomethyl)-6-methylphenol;2-[(4-methoxyphenyl)iminomethyl]-6-methylphenol;2-methyl-6-(pyridin-2-yliminomethyl)phenol;2-methyl-6-(pyridin-3-yliminomethyl)phenol;2-methyl-6-(pyridin-4-yliminomethyl)phenol;2-methyl-6-(pyrimidin-2-yliminomethyl)phenol;2-methyl-6-(pyrimidin-4-yliminomethyl)phenol;2-methyl-6-(quinolin-8-yliminomethyl)phenol;2-methyl-6-(1,3,5-triazin-2-yliminomethyl)phenol;2-(phenyliminomethyl)-3,5-bis(trifluoromethyl)phenol is sourced from PubChem (CID 159448799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).