2-[4-(difluoromethoxy)anilino]-6-[2-(difluoromethyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]pyridine-4-carbonitrile;2-[4-(difluoromethoxy)-3-methylanilino]-6-[2-(difluoromethyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]pyridine-4-carbonitrile;2-[2-(difluoromethyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]-6-[4-(trifluoromethyl)anilino]pyridine-4-carbonitrile;2-[2-(difluoromethyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]-6-[[6-(trifluoromethyl)-3-pyridinyl]amino]pyridine-4-carbonitrile

C84H47F22N21O2 — CID 159060302

IUPAC2-[4-(difluoromethoxy)anilino]-6-[2-(difluoromethyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]pyridine-4-carbonitrile;2-[4-(difluoromethoxy)-3-methylanilino]-6-[2-(difluoromethyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]pyridine-4-carbonitrile;2-[2-(difluoromethyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]-6-[4-(trifluoromethyl)anilino]pyridine-4-carbonitrile;2-[2-(difluoromethyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]-6-[[6-(trifluoromethyl)-3-pyridinyl]amino]pyridine-4-carbonitrile
SMILESCc1cc(Nc2cc(C#N)cc(-c3c(C(F)F)nc4ccc(F)cn34)n2)ccc1OC(F)F.N#Cc1cc(Nc2ccc(C(F)(F)F)cc2)nc(-c2c(C(F)F)nc3ccc(F)cn23)c1.N#Cc1cc(Nc2ccc(C(F)(F)F)nc2)nc(-c2c(C(F)F)nc3ccc(F)cn23)c1.N#Cc1cc(Nc2ccc(OC(F)F)cc2)nc(-c2c(C(F)F)nc3ccc(F)cn23)c1
InChIInChI=1S/C22H14F5N5O.C21H11F6N5.C21H12F5N5O.C20H10F6N6/c1-11-6-14(3-4-16(11)33-22(26)27)29-17-8-12(9-28)7-15(30-17)20-19(21(24)25)31-18-5-2-13(23)10-32(18)20;22-13-3-6-17-31-18(20(23)24)19(32(17)10-13)15-7-11(9-28)8-16(30-15)29-14-4-1-12(2-5-14)21(25,26)27;22-12-1-6-17-30-18(20(23)24)19(31(17)10-12)15-7-11(9-27)8-16(29-15)28-13-2-4-14(5-3-13)32-21(25)26;21-11-1-4-16-31-17(19(22)23)18(32(16)9-11)13-5-10(7-27)6-15(30-13)29-12-2-3-14(28-8-12)20(24,25)26/h2-8,10,21-22H,1H3,(H,29,30);1-8,10,20H,(H,29,30);1-8,10,20-21H,(H,28,29);1-6,8-9,19H,(H,29,30)
InChIKeyJYJNJXIRLMFIHF-UHFFFAOYSA-N
MW1800.40 g/mol
LogP23.30
Rot. Bonds20

About 2-[4-(difluoromethoxy)anilino]-6-[2-(difluoromethyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]pyridine-4-carbonitrile;2-[4-(difluoromethoxy)-3-methylanilino]-6-[2-(difluoromethyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]pyridine-4-carbonitrile;2-[2-(difluoromethyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]-6-[4-(trifluoromethyl)anilino]pyridine-4-carbonitrile;2-[2-(difluoromethyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]-6-[[6-(trifluoromethyl)-3-pyridinyl]amino]pyridine-4-carbonitrile

2-[4-(difluoromethoxy)anilino]-6-[2-(difluoromethyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]pyridine-4-carbonitrile;2-[4-(difluoromethoxy)-3-methylanilino]-6-[2-(difluoromethyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]pyridine-4-carbonitrile;2-[2-(difluoromethyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]-6-[4-(trifluoromethyl)anilino]pyridine-4-carbonitrile;2-[2-(difluoromethyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]-6-[[6-(trifluoromethyl)-3-pyridinyl]amino]pyridine-4-carbonitrile (PubChem CID 159060302) has the molecular formula C84H47F22N21O2 and a molecular weight of 1800.40 g/mol. Its IUPAC name is 2-[4-(difluoromethoxy)anilino]-6-[2-(difluoromethyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]pyridine-4-carbonitrile;2-[4-(difluoromethoxy)-3-methylanilino]-6-[2-(difluoromethyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]pyridine-4-carbonitrile;2-[2-(difluoromethyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]-6-[4-(trifluoromethyl)anilino]pyridine-4-carbonitrile;2-[2-(difluoromethyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]-6-[[6-(trifluoromethyl)-3-pyridinyl]amino]pyridine-4-carbonitrile.

Molecular Properties

Compound Name2-[4-(difluoromethoxy)anilino]-6-[2-(difluoromethyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]pyridine-4-carbonitrile;2-[4-(difluoromethoxy)-3-methylanilino]-6-[2-(difluoromethyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]pyridine-4-carbonitrile;2-[2-(difluoromethyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]-6-[4-(trifluoromethyl)anilino]pyridine-4-carbonitrile;2-[2-(difluoromethyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]-6-[[6-(trifluoromethyl)-3-pyridinyl]amino]pyridine-4-carbonitrile
PubChem CID159060302
Molecular FormulaC84H47F22N21O2
Molecular Weight1800.40 g/mol
Exact Mass1799.39
IUPAC Name2-[4-(difluoromethoxy)anilino]-6-[2-(difluoromethyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]pyridine-4-carbonitrile;2-[4-(difluoromethoxy)-3-methylanilino]-6-[2-(difluoromethyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]pyridine-4-carbonitrile;2-[2-(difluoromethyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]-6-[4-(trifluoromethyl)anilino]pyridine-4-carbonitrile;2-[2-(difluoromethyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]-6-[[6-(trifluoromethyl)-3-pyridinyl]amino]pyridine-4-carbonitrile
SMILESCc1cc(Nc2cc(C#N)cc(-c3c(C(F)F)nc4ccc(F)cn34)n2)ccc1OC(F)F.N#Cc1cc(Nc2ccc(C(F)(F)F)cc2)nc(-c2c(C(F)F)nc3ccc(F)cn23)c1.N#Cc1cc(Nc2ccc(C(F)(F)F)nc2)nc(-c2c(C(F)F)nc3ccc(F)cn23)c1.N#Cc1cc(Nc2ccc(OC(F)F)cc2)nc(-c2c(C(F)F)nc3ccc(F)cn23)c1
InChIInChI=1S/C22H14F5N5O.C21H11F6N5.C21H12F5N5O.C20H10F6N6/c1-11-6-14(3-4-16(11)33-22(26)27)29-17-8-12(9-28)7-15(30-17)20-19(21(24)25)31-18-5-2-13(23)10-32(18)20;22-13-3-6-17-31-18(20(23)24)19(32(17)10-13)15-7-11(9-28)8-16(30-15)29-14-4-1-12(2-5-14)21(25,26)27;22-12-1-6-17-30-18(20(23)24)19(31(17)10-12)15-7-11(9-27)8-16(29-15)28-13-2-4-14(5-3-13)32-21(25)26;21-11-1-4-16-31-17(19(22)23)18(32(16)9-11)13-5-10(7-27)6-15(30-13)29-12-2-3-14(28-8-12)20(24,25)26/h2-8,10,21-22H,1H3,(H,29,30);1-8,10,20H,(H,29,30);1-8,10,20-21H,(H,28,29);1-6,8-9,19H,(H,29,30)
InChIKeyJYJNJXIRLMFIHF-UHFFFAOYSA-N
XLogP23.30
TPSA295.39 Ų
H-Bond Donors4
H-Bond Acceptors23
Rotatable Bonds20
Heavy Atoms129
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001800.40
LogP ≤ 523.30
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1023

Analyze 2-[4-(difluoromethoxy)anilino]-6-[2-(difluoromethyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]pyridine-4-carbonitrile;2-[4-(difluoromethoxy)-3-methylanilino]-6-[2-(difluoromethyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]pyridine-4-carbonitrile;2-[2-(difluoromethyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]-6-[4-(trifluoromethyl)anilino]pyridine-4-carbonitrile;2-[2-(difluoromethyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]-6-[[6-(trifluoromethyl)-3-pyridinyl]amino]pyridine-4-carbonitrile with MolForge

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Related Compounds

1-(5-(4-amino-7-isopropyl-7H-pyrrolo[2,3-d]pyrimidin-5-yl)imidazo[1,2-a]pyridin-8-yl)-3-(4-((1-ethylpiperidin-4-yl)oxy)-3-(trifluoromethyl)-phenyl)urea
CID 171090988
1-(5-(4-amino-7-isopropyl-7H-pyrrolo[2,3-d]pyrimidin-5-yl)imidazo[1,2-a]pyridin-8-yl)-3-(4-((1-methylpiperidin-4-yl)oxy)-3-(trifluoromethyl)-phenyl)urea
CID 171091220
1-[4-Methoxy-3-(trifluoromethyl)phenyl]-3-[3-[8-(2-pyridin-4-ylimidazol-1-yl)imidazo[1,2-a]pyrazin-6-yl]phenyl]urea
CID 10437996
1-[3-[8-[2-Aminoethyl(pyridin-4-ylmethyl)amino]imidazo[1,2-a]pyrazin-6-yl]phenyl]-3-[4-methoxy-3-(trifluoromethyl)phenyl]urea
CID 58934042
1-[3-[8-[[2-Aminoethyl(pyridin-4-ylmethyl)amino]methyl]imidazo[1,2-a]pyrazin-6-yl]phenyl]-3-[4-methoxy-3-(trifluoromethyl)phenyl]urea
CID 58934048
1-[3-[8-[(3-Amino-1-pyridin-4-ylpropyl)amino]imidazo[1,2-a]pyrazin-6-yl]phenyl]-3-[4-methoxy-3-(trifluoromethyl)phenyl]urea
CID 69458582
2-(4-Methoxyanilino)-6-[2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyridine-3-carbonitrile
CID 118094803
2-[4-(Difluoromethoxy)-3-fluoroanilino]-6-(6-fluoro-2-methylimidazo[1,2-a]pyridin-3-yl)pyridine-4-carbonitrile
CID 118094830
2-[4-(Difluoromethoxy)anilino]-6-(6-fluoro-2-methylimidazo[1,2-a]pyridin-3-yl)pyridine-4-carbonitrile
CID 118094833
2-(6-Fluoro-2-methylimidazo[1,2-a]pyridin-3-yl)-6-(4-methoxyanilino)pyridine-4-carbonitrile
CID 118094853
2-[4-(Difluoromethoxy)anilino]-6-[2-(difluoromethyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]pyridine-4-carbonitrile
CID 118094861
2-[4-(Trifluoromethoxy)anilino]-6-[2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyridine-4-carbonitrile
CID 118094888

Frequently Asked Questions

What is the IUPAC name of 2-[4-(difluoromethoxy)anilino]-6-[2-(difluoromethyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]pyridine-4-carbonitrile;2-[4-(difluoromethoxy)-3-methylanilino]-6-[2-(difluoromethyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]pyridine-4-carbonitrile;2-[2-(difluoromethyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]-6-[4-(trifluoromethyl)anilino]pyridine-4-carbonitrile;2-[2-(difluoromethyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]-6-[[6-(trifluoromethyl)-3-pyridinyl]amino]pyridine-4-carbonitrile?
The IUPAC name of 2-[4-(difluoromethoxy)anilino]-6-[2-(difluoromethyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]pyridine-4-carbonitrile;2-[4-(difluoromethoxy)-3-methylanilino]-6-[2-(difluoromethyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]pyridine-4-carbonitrile;2-[2-(difluoromethyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]-6-[4-(trifluoromethyl)anilino]pyridine-4-carbonitrile;2-[2-(difluoromethyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]-6-[[6-(trifluoromethyl)-3-pyridinyl]amino]pyridine-4-carbonitrile (CID 159060302) is 2-[4-(difluoromethoxy)anilino]-6-[2-(difluoromethyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]pyridine-4-carbonitrile;2-[4-(difluoromethoxy)-3-methylanilino]-6-[2-(difluoromethyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]pyridine-4-carbonitrile;2-[2-(difluoromethyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]-6-[4-(trifluoromethyl)anilino]pyridine-4-carbonitrile;2-[2-(difluoromethyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]-6-[[6-(trifluoromethyl)-3-pyridinyl]amino]pyridine-4-carbonitrile.
What is the SMILES notation for 2-[4-(difluoromethoxy)anilino]-6-[2-(difluoromethyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]pyridine-4-carbonitrile;2-[4-(difluoromethoxy)-3-methylanilino]-6-[2-(difluoromethyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]pyridine-4-carbonitrile;2-[2-(difluoromethyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]-6-[4-(trifluoromethyl)anilino]pyridine-4-carbonitrile;2-[2-(difluoromethyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]-6-[[6-(trifluoromethyl)-3-pyridinyl]amino]pyridine-4-carbonitrile?
The canonical SMILES for 2-[4-(difluoromethoxy)anilino]-6-[2-(difluoromethyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]pyridine-4-carbonitrile;2-[4-(difluoromethoxy)-3-methylanilino]-6-[2-(difluoromethyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]pyridine-4-carbonitrile;2-[2-(difluoromethyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]-6-[4-(trifluoromethyl)anilino]pyridine-4-carbonitrile;2-[2-(difluoromethyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]-6-[[6-(trifluoromethyl)-3-pyridinyl]amino]pyridine-4-carbonitrile is Cc1cc(Nc2cc(C#N)cc(-c3c(C(F)F)nc4ccc(F)cn34)n2)ccc1OC(F)F.N#Cc1cc(Nc2ccc(C(F)(F)F)cc2)nc(-c2c(C(F)F)nc3ccc(F)cn23)c1.N#Cc1cc(Nc2ccc(C(F)(F)F)nc2)nc(-c2c(C(F)F)nc3ccc(F)cn23)c1.N#Cc1cc(Nc2ccc(OC(F)F)cc2)nc(-c2c(C(F)F)nc3ccc(F)cn23)c1.
What is the InChIKey of 2-[4-(difluoromethoxy)anilino]-6-[2-(difluoromethyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]pyridine-4-carbonitrile;2-[4-(difluoromethoxy)-3-methylanilino]-6-[2-(difluoromethyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]pyridine-4-carbonitrile;2-[2-(difluoromethyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]-6-[4-(trifluoromethyl)anilino]pyridine-4-carbonitrile;2-[2-(difluoromethyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]-6-[[6-(trifluoromethyl)-3-pyridinyl]amino]pyridine-4-carbonitrile?
The InChIKey is JYJNJXIRLMFIHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H14F5N5O.C21H11F6N5.C21H12F5N5O.C20H10F6N6/c1-11-6-14(3-4-16(11)33-22(26)27)29-17-8-12(9-28)7-15(30-17)20-19(21(24)25)31-18-5-2-13(23)10-32(18)20;22-13-3-6-17-31-18(20(23)24)19(32(17)10-13)15-7-11(9-28)8-16(30-15)29-14-4-1-12(2-5-14)21(25,26)27;22-12-1-6-17-30-18(20(23)24)19(31(17)10-12)15-7-11(9-27)8-16(29-15)28-13-2-4-14(5-3-13)32-21(25)26;21-11-1-4-16-31-17(19(22)23)18(32(16)9-11)13-5-10(7-27)6-15(30-13)29-12-2-3-14(28-8-12)20(24,25)26/h2-8,10,21-22H,1H3,(H,29,30);1-8,10,20H,(H,29,30);1-8,10,20-21H,(H,28,29);1-6,8-9,19H,(H,29,30).
What are the key properties of 2-[4-(difluoromethoxy)anilino]-6-[2-(difluoromethyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]pyridine-4-carbonitrile;2-[4-(difluoromethoxy)-3-methylanilino]-6-[2-(difluoromethyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]pyridine-4-carbonitrile;2-[2-(difluoromethyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]-6-[4-(trifluoromethyl)anilino]pyridine-4-carbonitrile;2-[2-(difluoromethyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]-6-[[6-(trifluoromethyl)-3-pyridinyl]amino]pyridine-4-carbonitrile?
2-[4-(difluoromethoxy)anilino]-6-[2-(difluoromethyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]pyridine-4-carbonitrile;2-[4-(difluoromethoxy)-3-methylanilino]-6-[2-(difluoromethyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]pyridine-4-carbonitrile;2-[2-(difluoromethyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]-6-[4-(trifluoromethyl)anilino]pyridine-4-carbonitrile;2-[2-(difluoromethyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]-6-[[6-(trifluoromethyl)-3-pyridinyl]amino]pyridine-4-carbonitrile has a molecular weight of 1800.40 g/mol, XLogP of 23.30, 20 rotatable bonds, 4 hydrogen bond donors, and 23 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(difluoromethoxy)anilino]-6-[2-(difluoromethyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]pyridine-4-carbonitrile;2-[4-(difluoromethoxy)-3-methylanilino]-6-[2-(difluoromethyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]pyridine-4-carbonitrile;2-[2-(difluoromethyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]-6-[4-(trifluoromethyl)anilino]pyridine-4-carbonitrile;2-[2-(difluoromethyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]-6-[[6-(trifluoromethyl)-3-pyridinyl]amino]pyridine-4-carbonitrile is sourced from PubChem (CID 159060302), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).