6-fluoro-N-(6-methyl-3-pyridinyl)-1,2-benzoxazol-3-amine;7-fluoro-N-(6-methyl-3-pyridinyl)-1,2-benzoxazol-3-amine;6-fluoro-N-(6-methyl-3-pyridinyl)-1H-indazol-3-amine;7-fluoro-N-(6-methyl-3-pyridinyl)-1H-indazol-3-amine;7-fluoro-N-(6-methyl-3-pyridinyl)-6-(trifluoromethyl)-1H-indazol-3-amine;N-(6-methyl-3-pyridinyl)-6-(trifluoromethyl)-1,2-benzoxazol-3-amine;N-(6-methyl-3-pyridinyl)-7-(trifluoromethyl)-1,2-benzoxazol-3-amine;N-(6-methyl-3-pyridinyl)-6-(trifluoromethyl)-1H-indazol-3-amine

C108H83F17N28O4 — CID 160874523

IUPAC6-fluoro-N-(6-methyl-3-pyridinyl)-1,2-benzoxazol-3-amine;7-fluoro-N-(6-methyl-3-pyridinyl)-1,2-benzoxazol-3-amine;6-fluoro-N-(6-methyl-3-pyridinyl)-1H-indazol-3-amine;7-fluoro-N-(6-methyl-3-pyridinyl)-1H-indazol-3-amine;7-fluoro-N-(6-methyl-3-pyridinyl)-6-(trifluoromethyl)-1H-indazol-3-amine;N-(6-methyl-3-pyridinyl)-6-(trifluoromethyl)-1,2-benzoxazol-3-amine;N-(6-methyl-3-pyridinyl)-7-(trifluoromethyl)-1,2-benzoxazol-3-amine;N-(6-methyl-3-pyridinyl)-6-(trifluoromethyl)-1H-indazol-3-amine
SMILESCc1ccc(Nc2n[nH]c3c(F)c(C(F)(F)F)ccc23)cn1.Cc1ccc(Nc2n[nH]c3c(F)cccc23)cn1.Cc1ccc(Nc2n[nH]c3cc(C(F)(F)F)ccc23)cn1.Cc1ccc(Nc2n[nH]c3cc(F)ccc23)cn1.Cc1ccc(Nc2noc3c(C(F)(F)F)cccc23)cn1.Cc1ccc(Nc2noc3c(F)cccc23)cn1.Cc1ccc(Nc2noc3cc(C(F)(F)F)ccc23)cn1.Cc1ccc(Nc2noc3cc(F)ccc23)cn1
InChIInChI=1S/C14H10F4N4.C14H11F3N4.2C14H10F3N3O.2C13H11FN4.2C13H10FN3O/c1-7-2-3-8(6-19-7)20-13-9-4-5-10(14(16,17)18)11(15)12(9)21-22-13;1-8-2-4-10(7-18-8)19-13-11-5-3-9(14(15,16)17)6-12(11)20-21-13;1-8-2-4-10(7-18-8)19-13-11-5-3-9(14(15,16)17)6-12(11)21-20-13;1-8-5-6-9(7-18-8)19-13-10-3-2-4-11(14(15,16)17)12(10)21-20-13;1-8-2-4-10(7-15-8)16-13-11-5-3-9(14)6-12(11)17-18-13;1-8-5-6-9(7-15-8)16-13-10-3-2-4-11(14)12(10)17-18-13;1-8-2-4-10(7-15-8)16-13-11-5-3-9(14)6-12(11)18-17-13;1-8-5-6-9(7-15-8)16-13-10-3-2-4-11(14)12(10)18-17-13/h2-6H,1H3,(H2,20,21,22);2-7H,1H3,(H2,19,20,21);2*2-7H,1H3,(H,19,20);2*2-7H,1H3,(H2,16,17,18);2*2-7H,1H3,(H,16,17)
InChIKeySMFAAIPJTCXIOW-UHFFFAOYSA-N
MW2160.01 g/mol
LogP29.91
Rot. Bonds16

About 6-fluoro-N-(6-methyl-3-pyridinyl)-1,2-benzoxazol-3-amine;7-fluoro-N-(6-methyl-3-pyridinyl)-1,2-benzoxazol-3-amine;6-fluoro-N-(6-methyl-3-pyridinyl)-1H-indazol-3-amine;7-fluoro-N-(6-methyl-3-pyridinyl)-1H-indazol-3-amine;7-fluoro-N-(6-methyl-3-pyridinyl)-6-(trifluoromethyl)-1H-indazol-3-amine;N-(6-methyl-3-pyridinyl)-6-(trifluoromethyl)-1,2-benzoxazol-3-amine;N-(6-methyl-3-pyridinyl)-7-(trifluoromethyl)-1,2-benzoxazol-3-amine;N-(6-methyl-3-pyridinyl)-6-(trifluoromethyl)-1H-indazol-3-amine

6-fluoro-N-(6-methyl-3-pyridinyl)-1,2-benzoxazol-3-amine;7-fluoro-N-(6-methyl-3-pyridinyl)-1,2-benzoxazol-3-amine;6-fluoro-N-(6-methyl-3-pyridinyl)-1H-indazol-3-amine;7-fluoro-N-(6-methyl-3-pyridinyl)-1H-indazol-3-amine;7-fluoro-N-(6-methyl-3-pyridinyl)-6-(trifluoromethyl)-1H-indazol-3-amine;N-(6-methyl-3-pyridinyl)-6-(trifluoromethyl)-1,2-benzoxazol-3-amine;N-(6-methyl-3-pyridinyl)-7-(trifluoromethyl)-1,2-benzoxazol-3-amine;N-(6-methyl-3-pyridinyl)-6-(trifluoromethyl)-1H-indazol-3-amine (PubChem CID 160874523) has the molecular formula C108H83F17N28O4 and a molecular weight of 2160.01 g/mol. Its IUPAC name is 6-fluoro-N-(6-methyl-3-pyridinyl)-1,2-benzoxazol-3-amine;7-fluoro-N-(6-methyl-3-pyridinyl)-1,2-benzoxazol-3-amine;6-fluoro-N-(6-methyl-3-pyridinyl)-1H-indazol-3-amine;7-fluoro-N-(6-methyl-3-pyridinyl)-1H-indazol-3-amine;7-fluoro-N-(6-methyl-3-pyridinyl)-6-(trifluoromethyl)-1H-indazol-3-amine;N-(6-methyl-3-pyridinyl)-6-(trifluoromethyl)-1,2-benzoxazol-3-amine;N-(6-methyl-3-pyridinyl)-7-(trifluoromethyl)-1,2-benzoxazol-3-amine;N-(6-methyl-3-pyridinyl)-6-(trifluoromethyl)-1H-indazol-3-amine.

Molecular Properties

Compound Name6-fluoro-N-(6-methyl-3-pyridinyl)-1,2-benzoxazol-3-amine;7-fluoro-N-(6-methyl-3-pyridinyl)-1,2-benzoxazol-3-amine;6-fluoro-N-(6-methyl-3-pyridinyl)-1H-indazol-3-amine;7-fluoro-N-(6-methyl-3-pyridinyl)-1H-indazol-3-amine;7-fluoro-N-(6-methyl-3-pyridinyl)-6-(trifluoromethyl)-1H-indazol-3-amine;N-(6-methyl-3-pyridinyl)-6-(trifluoromethyl)-1,2-benzoxazol-3-amine;N-(6-methyl-3-pyridinyl)-7-(trifluoromethyl)-1,2-benzoxazol-3-amine;N-(6-methyl-3-pyridinyl)-6-(trifluoromethyl)-1H-indazol-3-amine
PubChem CID160874523
Molecular FormulaC108H83F17N28O4
Molecular Weight2160.01 g/mol
Exact Mass2158.69
IUPAC Name6-fluoro-N-(6-methyl-3-pyridinyl)-1,2-benzoxazol-3-amine;7-fluoro-N-(6-methyl-3-pyridinyl)-1,2-benzoxazol-3-amine;6-fluoro-N-(6-methyl-3-pyridinyl)-1H-indazol-3-amine;7-fluoro-N-(6-methyl-3-pyridinyl)-1H-indazol-3-amine;7-fluoro-N-(6-methyl-3-pyridinyl)-6-(trifluoromethyl)-1H-indazol-3-amine;N-(6-methyl-3-pyridinyl)-6-(trifluoromethyl)-1,2-benzoxazol-3-amine;N-(6-methyl-3-pyridinyl)-7-(trifluoromethyl)-1,2-benzoxazol-3-amine;N-(6-methyl-3-pyridinyl)-6-(trifluoromethyl)-1H-indazol-3-amine
SMILESCc1ccc(Nc2n[nH]c3c(F)c(C(F)(F)F)ccc23)cn1.Cc1ccc(Nc2n[nH]c3c(F)cccc23)cn1.Cc1ccc(Nc2n[nH]c3cc(C(F)(F)F)ccc23)cn1.Cc1ccc(Nc2n[nH]c3cc(F)ccc23)cn1.Cc1ccc(Nc2noc3c(C(F)(F)F)cccc23)cn1.Cc1ccc(Nc2noc3c(F)cccc23)cn1.Cc1ccc(Nc2noc3cc(C(F)(F)F)ccc23)cn1.Cc1ccc(Nc2noc3cc(F)ccc23)cn1
InChIInChI=1S/C14H10F4N4.C14H11F3N4.2C14H10F3N3O.2C13H11FN4.2C13H10FN3O/c1-7-2-3-8(6-19-7)20-13-9-4-5-10(14(16,17)18)11(15)12(9)21-22-13;1-8-2-4-10(7-18-8)19-13-11-5-3-9(14(15,16)17)6-12(11)20-21-13;1-8-2-4-10(7-18-8)19-13-11-5-3-9(14(15,16)17)6-12(11)21-20-13;1-8-5-6-9(7-18-8)19-13-10-3-2-4-11(14(15,16)17)12(10)21-20-13;1-8-2-4-10(7-15-8)16-13-11-5-3-9(14)6-12(11)17-18-13;1-8-5-6-9(7-15-8)16-13-10-3-2-4-11(14)12(10)17-18-13;1-8-2-4-10(7-15-8)16-13-11-5-3-9(14)6-12(11)18-17-13;1-8-5-6-9(7-15-8)16-13-10-3-2-4-11(14)12(10)18-17-13/h2-6H,1H3,(H2,20,21,22);2-7H,1H3,(H2,19,20,21);2*2-7H,1H3,(H,19,20);2*2-7H,1H3,(H2,16,17,18);2*2-7H,1H3,(H,16,17)
InChIKeySMFAAIPJTCXIOW-UHFFFAOYSA-N
XLogP29.91
TPSA418.20 Ų
H-Bond Donors12
H-Bond Acceptors28
Rotatable Bonds16
Heavy Atoms157
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002160.01
LogP ≤ 529.91
H-Bond Donors ≤ 512
H-Bond Acceptors ≤ 1028

Analyze 6-fluoro-N-(6-methyl-3-pyridinyl)-1,2-benzoxazol-3-amine;7-fluoro-N-(6-methyl-3-pyridinyl)-1,2-benzoxazol-3-amine;6-fluoro-N-(6-methyl-3-pyridinyl)-1H-indazol-3-amine;7-fluoro-N-(6-methyl-3-pyridinyl)-1H-indazol-3-amine;7-fluoro-N-(6-methyl-3-pyridinyl)-6-(trifluoromethyl)-1H-indazol-3-amine;N-(6-methyl-3-pyridinyl)-6-(trifluoromethyl)-1,2-benzoxazol-3-amine;N-(6-methyl-3-pyridinyl)-7-(trifluoromethyl)-1,2-benzoxazol-3-amine;N-(6-methyl-3-pyridinyl)-6-(trifluoromethyl)-1H-indazol-3-amine with MolForge

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Related Compounds

1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]hexan-2-one;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-(2H-indazol-3-yl)propan-2-one;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-(5-methyl-1,2-oxazol-3-yl)propan-2-one;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-(3-methylphenyl)propan-2-one;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-(4-methyl-1H-pyrazol-5-yl)propan-2-one;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-[4-methyl-3-(trifluoromethyl)phenyl]propan-2-one;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-(3-propan-2-yl-1H-pyrazol-5-yl)propan-2-one
CID 157539510
3-(1,1-difluoro-2,2-dimethylpropyl)-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)-1,2-benzoxazol-6-amine;3-(1,1-difluoro-2,2-dimethylpropyl)-N-(2H-pyrazolo[3,4-b]pyridin-3-yl)-1,2-benzoxazol-6-amine;3-[(4-ethylpiperidin-1-yl)methyl]-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)-1,2-benzoxazol-6-amine;N-(2H-pyrazolo[3,4-b]pyrazin-3-yl)-3-(2,4,4-trimethylpentyl)-1,2-benzoxazol-6-amine;N-(2H-pyrazolo[3,4-b]pyridin-3-yl)-3-(2,4,4-trimethylpentyl)-1,2-benzoxazol-6-amine
CID 157662930
N,N-dimethyl-3-[[6-methyl-7-(2-pyrazolo[1,5-a]pyrimidin-3-ylethynyl)-1,2-benzoxazol-3-yl]methyl]aniline;7-(2-imidazo[1,2-a]pyrazin-3-ylethynyl)-6-methyl-3-[[3-(3-methylpyrrol-1-yl)-5-(trifluoromethyl)phenyl]methyl]-1,2-benzoxazole;7-(2-imidazo[1,2-a]pyridin-3-ylethynyl)-6-methyl-3-[[3-methyl-5-(piperidin-1-ylmethyl)phenyl]methyl]-1,2-benzoxazole
CID 158210941
3-(1,1-difluoropentyl)-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)-1,2-benzoxazol-6-amine;3-(1,1-difluoropentyl)-N-(2H-pyrazolo[3,4-b]pyridin-3-yl)-1,2-benzoxazol-6-amine;3-(5,5-dimethylhexan-2-yl)-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)-1,2-benzoxazol-6-amine;N-(1H-pyrazolo[4,3-b]pyridin-3-yl)-3-(2-pyrrolidin-1-ylethyl)-1,2-benzoxazol-6-amine
CID 158313099
1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]hexan-2-one;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-(2H-indazol-3-yl)propan-2-one;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-(5-methyl-1,2-oxazol-3-yl)propan-2-one;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-[4-methyl-3-(trifluoromethyl)phenyl]propan-2-one;5-[3-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-2-oxopropyl]-1H-pyrazole-4-carbonitrile;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-(3-propan-2-yl-1H-pyrazol-5-yl)propan-2-one
CID 158454656
7-(2-imidazo[1,2-b]pyridazin-3-ylethynyl)-3-[[3-(imidazol-1-ylmethyl)-5-(trifluoromethyl)phenyl]methyl]-6-methyl-1,2-benzoxazole;N-[[3-[[7-(2-imidazo[1,2-b]pyridazin-3-ylethynyl)-6-methyl-1,2-benzoxazol-3-yl]methyl]-5-(trifluoromethyl)phenyl]methyl]cyclopropanamine;7-(2-imidazo[1,2-b]pyridazin-3-ylethynyl)-6-methyl-3-[[3-(piperidin-1-ylmethyl)-5-(trifluoromethyl)phenyl]methyl]-1,2-benzoxazole;7-(2-imidazo[1,2-b]pyridazin-3-ylethynyl)-6-methyl-3-[[3-(pyrrolidin-1-ylmethyl)-5-(trifluoromethyl)phenyl]methyl]-1,2-benzoxazole
CID 158470085
(E)-2-(2-aminopyrimidin-5-yl)-3-[3-(3,5-dimethylphenyl)-1,2,4-triazol-1-yl]prop-2-enamide;(E)-2-(3,5-dimethyl-1,2-oxazol-4-yl)-3-[3-[3-methyl-5-(trifluoromethyl)phenyl]-1,2,4-triazol-1-yl]prop-2-enamide;(E)-3-[3-(3,5-dimethylphenyl)-1,2,4-triazol-1-yl]-2-(2-fluoro-3-pyridinyl)prop-2-enamide;(E)-3-[3-(3,5-dimethylphenyl)-1,2,4-triazol-1-yl]-2-(1H-indazol-6-yl)prop-2-enamide
CID 158765100
3-[2-[(3,3-difluorocyclobutyl)amino]prop-2-enyl]-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)-1,2-benzoxazol-6-amine;3-(1,1-difluoropentyl)-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)-1,2-benzoxazol-6-amine;3-(1,1-difluoropentyl)-N-(2H-pyrazolo[3,4-b]pyridin-3-yl)-1,2-benzoxazol-6-amine;3-(5,5-dimethylhexan-2-yl)-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)-1,2-benzoxazol-6-amine;3-[1-(6-methylidene-1H-pyridin-3-yl)ethyl]-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)-1,2-benzoxazol-6-amine
CID 158926049
7-[2-(2H-benzotriazol-5-yl)ethynyl]-6-methyl-3-[[3-methyl-5-[(4-methylpiperazin-1-yl)methyl]phenyl]methyl]-1,2-benzoxazole;7-(2-imidazo[1,5-a]pyridin-6-ylethynyl)-6-methyl-3-[[3-(piperidin-1-ylmethyl)-5-(trifluoromethyl)phenyl]methyl]-1,2-benzoxazole;6-methyl-3-[[3-[(4-methylpiperazin-1-yl)methyl]-5-(trifluoromethyl)phenyl]methyl]-7-[2-(1H-pyrazolo[3,4-c]pyridin-5-yl)ethynyl]-1,2-benzoxazole;6-methyl-3-[[3-methyl-5-(trifluoromethyl)phenyl]methyl]-7-[2-(tetrazolo[1,5-a]pyridin-6-yl)ethynyl]-1,2-benzoxazole
CID 159047536
3-[[3-(1,1-difluoroethyl)phenyl]methyl]-7-(2-indazol-2-ium-6-ylethynyl)-6-methyl-1,2-benzoxazole;3-[[3-(1,1-difluoroethyl)phenyl]methyl]-6-methyl-7-[2-(1H-pyrazolo[4,5-b]pyridin-5-yl)ethynyl]-1,2-benzoxazole;3-[[3-(1,1-difluoroethyl)phenyl]methyl]-6-methyl-7-[2-(1H-pyrazolo[5,4-b]pyridin-5-yl)ethynyl]-1,2-benzoxazole
CID 159297897
1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-[2-fluoro-5-(trifluoromethyl)phenyl]propan-2-one;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-(2H-indazol-3-yl)propan-2-one;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-(5-methyl-1,2-oxazol-3-yl)propan-2-one;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-(4-methyl-1H-pyrazol-5-yl)propan-2-one;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-[4-methyl-3-(trifluoromethyl)phenyl]propan-2-one;1-[4-(3-aminotriazolo[1,5-a]pyridin-4-yl)phenyl]-3-(3-propan-2-yl-1H-pyrazol-5-yl)propan-2-one
CID 159324046
1-[3-(2,1,3-benzoxadiazol-5-yl)-1H-indazol-5-yl]-2-[(3S,5S)-1-[(2-fluoro-6-methoxyphenyl)methyl]-5-methylpiperidin-3-yl]ethanone;1-[3-(2,1,3-benzoxadiazol-5-yl)-1H-indazol-5-yl]-2-[(3S,5R)-1-[(2-fluoro-6-methoxyphenyl)methyl]-5-methylpiperidin-3-yl]ethanone;2-[(3S,5S)-5-(1,1-difluoroethyl)-1-[(2-fluoro-6-methoxyphenyl)methyl]piperidin-3-yl]-1-(3-imidazo[1,2-a]pyridin-6-yl-1H-isoindol-5-yl)ethanone;2-[(3R,5R)-5-(1,1-difluoroethyl)-1-[(2-fluoro-6-methoxyphenyl)methyl]piperidin-3-yl]-1-[3-(2-methylindazol-5-yl)-1H-isoindol-5-yl]ethanone;2-[(3S,5S)-1-[(2-fluoro-6-methoxyphenyl)methyl]-5-methylpiperidin-3-yl]-1-[3-([1,2,4]triazolo[1,5-a]pyridin-7-yl)-1H-isoindol-5-yl]ethanone
CID 159356126

Frequently Asked Questions

What is the IUPAC name of 6-fluoro-N-(6-methyl-3-pyridinyl)-1,2-benzoxazol-3-amine;7-fluoro-N-(6-methyl-3-pyridinyl)-1,2-benzoxazol-3-amine;6-fluoro-N-(6-methyl-3-pyridinyl)-1H-indazol-3-amine;7-fluoro-N-(6-methyl-3-pyridinyl)-1H-indazol-3-amine;7-fluoro-N-(6-methyl-3-pyridinyl)-6-(trifluoromethyl)-1H-indazol-3-amine;N-(6-methyl-3-pyridinyl)-6-(trifluoromethyl)-1,2-benzoxazol-3-amine;N-(6-methyl-3-pyridinyl)-7-(trifluoromethyl)-1,2-benzoxazol-3-amine;N-(6-methyl-3-pyridinyl)-6-(trifluoromethyl)-1H-indazol-3-amine?
The IUPAC name of 6-fluoro-N-(6-methyl-3-pyridinyl)-1,2-benzoxazol-3-amine;7-fluoro-N-(6-methyl-3-pyridinyl)-1,2-benzoxazol-3-amine;6-fluoro-N-(6-methyl-3-pyridinyl)-1H-indazol-3-amine;7-fluoro-N-(6-methyl-3-pyridinyl)-1H-indazol-3-amine;7-fluoro-N-(6-methyl-3-pyridinyl)-6-(trifluoromethyl)-1H-indazol-3-amine;N-(6-methyl-3-pyridinyl)-6-(trifluoromethyl)-1,2-benzoxazol-3-amine;N-(6-methyl-3-pyridinyl)-7-(trifluoromethyl)-1,2-benzoxazol-3-amine;N-(6-methyl-3-pyridinyl)-6-(trifluoromethyl)-1H-indazol-3-amine (CID 160874523) is 6-fluoro-N-(6-methyl-3-pyridinyl)-1,2-benzoxazol-3-amine;7-fluoro-N-(6-methyl-3-pyridinyl)-1,2-benzoxazol-3-amine;6-fluoro-N-(6-methyl-3-pyridinyl)-1H-indazol-3-amine;7-fluoro-N-(6-methyl-3-pyridinyl)-1H-indazol-3-amine;7-fluoro-N-(6-methyl-3-pyridinyl)-6-(trifluoromethyl)-1H-indazol-3-amine;N-(6-methyl-3-pyridinyl)-6-(trifluoromethyl)-1,2-benzoxazol-3-amine;N-(6-methyl-3-pyridinyl)-7-(trifluoromethyl)-1,2-benzoxazol-3-amine;N-(6-methyl-3-pyridinyl)-6-(trifluoromethyl)-1H-indazol-3-amine.
What is the SMILES notation for 6-fluoro-N-(6-methyl-3-pyridinyl)-1,2-benzoxazol-3-amine;7-fluoro-N-(6-methyl-3-pyridinyl)-1,2-benzoxazol-3-amine;6-fluoro-N-(6-methyl-3-pyridinyl)-1H-indazol-3-amine;7-fluoro-N-(6-methyl-3-pyridinyl)-1H-indazol-3-amine;7-fluoro-N-(6-methyl-3-pyridinyl)-6-(trifluoromethyl)-1H-indazol-3-amine;N-(6-methyl-3-pyridinyl)-6-(trifluoromethyl)-1,2-benzoxazol-3-amine;N-(6-methyl-3-pyridinyl)-7-(trifluoromethyl)-1,2-benzoxazol-3-amine;N-(6-methyl-3-pyridinyl)-6-(trifluoromethyl)-1H-indazol-3-amine?
The canonical SMILES for 6-fluoro-N-(6-methyl-3-pyridinyl)-1,2-benzoxazol-3-amine;7-fluoro-N-(6-methyl-3-pyridinyl)-1,2-benzoxazol-3-amine;6-fluoro-N-(6-methyl-3-pyridinyl)-1H-indazol-3-amine;7-fluoro-N-(6-methyl-3-pyridinyl)-1H-indazol-3-amine;7-fluoro-N-(6-methyl-3-pyridinyl)-6-(trifluoromethyl)-1H-indazol-3-amine;N-(6-methyl-3-pyridinyl)-6-(trifluoromethyl)-1,2-benzoxazol-3-amine;N-(6-methyl-3-pyridinyl)-7-(trifluoromethyl)-1,2-benzoxazol-3-amine;N-(6-methyl-3-pyridinyl)-6-(trifluoromethyl)-1H-indazol-3-amine is Cc1ccc(Nc2n[nH]c3c(F)c(C(F)(F)F)ccc23)cn1.Cc1ccc(Nc2n[nH]c3c(F)cccc23)cn1.Cc1ccc(Nc2n[nH]c3cc(C(F)(F)F)ccc23)cn1.Cc1ccc(Nc2n[nH]c3cc(F)ccc23)cn1.Cc1ccc(Nc2noc3c(C(F)(F)F)cccc23)cn1.Cc1ccc(Nc2noc3c(F)cccc23)cn1.Cc1ccc(Nc2noc3cc(C(F)(F)F)ccc23)cn1.Cc1ccc(Nc2noc3cc(F)ccc23)cn1.
What is the InChIKey of 6-fluoro-N-(6-methyl-3-pyridinyl)-1,2-benzoxazol-3-amine;7-fluoro-N-(6-methyl-3-pyridinyl)-1,2-benzoxazol-3-amine;6-fluoro-N-(6-methyl-3-pyridinyl)-1H-indazol-3-amine;7-fluoro-N-(6-methyl-3-pyridinyl)-1H-indazol-3-amine;7-fluoro-N-(6-methyl-3-pyridinyl)-6-(trifluoromethyl)-1H-indazol-3-amine;N-(6-methyl-3-pyridinyl)-6-(trifluoromethyl)-1,2-benzoxazol-3-amine;N-(6-methyl-3-pyridinyl)-7-(trifluoromethyl)-1,2-benzoxazol-3-amine;N-(6-methyl-3-pyridinyl)-6-(trifluoromethyl)-1H-indazol-3-amine?
The InChIKey is SMFAAIPJTCXIOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10F4N4.C14H11F3N4.2C14H10F3N3O.2C13H11FN4.2C13H10FN3O/c1-7-2-3-8(6-19-7)20-13-9-4-5-10(14(16,17)18)11(15)12(9)21-22-13;1-8-2-4-10(7-18-8)19-13-11-5-3-9(14(15,16)17)6-12(11)20-21-13;1-8-2-4-10(7-18-8)19-13-11-5-3-9(14(15,16)17)6-12(11)21-20-13;1-8-5-6-9(7-18-8)19-13-10-3-2-4-11(14(15,16)17)12(10)21-20-13;1-8-2-4-10(7-15-8)16-13-11-5-3-9(14)6-12(11)17-18-13;1-8-5-6-9(7-15-8)16-13-10-3-2-4-11(14)12(10)17-18-13;1-8-2-4-10(7-15-8)16-13-11-5-3-9(14)6-12(11)18-17-13;1-8-5-6-9(7-15-8)16-13-10-3-2-4-11(14)12(10)18-17-13/h2-6H,1H3,(H2,20,21,22);2-7H,1H3,(H2,19,20,21);2*2-7H,1H3,(H,19,20);2*2-7H,1H3,(H2,16,17,18);2*2-7H,1H3,(H,16,17).
What are the key properties of 6-fluoro-N-(6-methyl-3-pyridinyl)-1,2-benzoxazol-3-amine;7-fluoro-N-(6-methyl-3-pyridinyl)-1,2-benzoxazol-3-amine;6-fluoro-N-(6-methyl-3-pyridinyl)-1H-indazol-3-amine;7-fluoro-N-(6-methyl-3-pyridinyl)-1H-indazol-3-amine;7-fluoro-N-(6-methyl-3-pyridinyl)-6-(trifluoromethyl)-1H-indazol-3-amine;N-(6-methyl-3-pyridinyl)-6-(trifluoromethyl)-1,2-benzoxazol-3-amine;N-(6-methyl-3-pyridinyl)-7-(trifluoromethyl)-1,2-benzoxazol-3-amine;N-(6-methyl-3-pyridinyl)-6-(trifluoromethyl)-1H-indazol-3-amine?
6-fluoro-N-(6-methyl-3-pyridinyl)-1,2-benzoxazol-3-amine;7-fluoro-N-(6-methyl-3-pyridinyl)-1,2-benzoxazol-3-amine;6-fluoro-N-(6-methyl-3-pyridinyl)-1H-indazol-3-amine;7-fluoro-N-(6-methyl-3-pyridinyl)-1H-indazol-3-amine;7-fluoro-N-(6-methyl-3-pyridinyl)-6-(trifluoromethyl)-1H-indazol-3-amine;N-(6-methyl-3-pyridinyl)-6-(trifluoromethyl)-1,2-benzoxazol-3-amine;N-(6-methyl-3-pyridinyl)-7-(trifluoromethyl)-1,2-benzoxazol-3-amine;N-(6-methyl-3-pyridinyl)-6-(trifluoromethyl)-1H-indazol-3-amine has a molecular weight of 2160.01 g/mol, XLogP of 29.91, 16 rotatable bonds, 12 hydrogen bond donors, and 28 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-N-(6-methyl-3-pyridinyl)-1,2-benzoxazol-3-amine;7-fluoro-N-(6-methyl-3-pyridinyl)-1,2-benzoxazol-3-amine;6-fluoro-N-(6-methyl-3-pyridinyl)-1H-indazol-3-amine;7-fluoro-N-(6-methyl-3-pyridinyl)-1H-indazol-3-amine;7-fluoro-N-(6-methyl-3-pyridinyl)-6-(trifluoromethyl)-1H-indazol-3-amine;N-(6-methyl-3-pyridinyl)-6-(trifluoromethyl)-1,2-benzoxazol-3-amine;N-(6-methyl-3-pyridinyl)-7-(trifluoromethyl)-1,2-benzoxazol-3-amine;N-(6-methyl-3-pyridinyl)-6-(trifluoromethyl)-1H-indazol-3-amine is sourced from PubChem (CID 160874523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).