N-[4-(difluoromethoxy)phenyl]-6-(2-methylindol-1-yl)pyrazin-2-amine;4-N-(2-methoxyethyl)-6-[2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-2-N-[4-(trifluoromethyl)phenyl]pyridine-2,4-diamine;6-(2-methylindol-1-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine;2-[[2-[4-(trifluoromethyl)anilino]-6-[2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-4-pyridinyl]amino]ethanol

C85H67F17N18O3 — CID 159592155

About N-[4-(difluoromethoxy)phenyl]-6-(2-methylindol-1-yl)pyrazin-2-amine;4-N-(2-methoxyethyl)-6-[2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-2-N-[4-(trifluoromethyl)phenyl]pyridine-2,4-diamine;6-(2-methylindol-1-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine;2-[[2-[4-(trifluoromethyl)anilino]-6-[2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-4-pyridinyl]amino]ethanol

N-[4-(difluoromethoxy)phenyl]-6-(2-methylindol-1-yl)pyrazin-2-amine;4-N-(2-methoxyethyl)-6-[2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-2-N-[4-(trifluoromethyl)phenyl]pyridine-2,4-diamine;6-(2-methylindol-1-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine;2-[[2-[4-(trifluoromethyl)anilino]-6-[2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-4-pyridinyl]amino]ethanol (PubChem CID 159592155) has the molecular formula C85H67F17N18O3 and a molecular weight of 1711.56 g/mol. Its IUPAC name is N-[4-(difluoromethoxy)phenyl]-6-(2-methylindol-1-yl)pyrazin-2-amine;4-N-(2-methoxyethyl)-6-[2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-2-N-[4-(trifluoromethyl)phenyl]pyridine-2,4-diamine;6-(2-methylindol-1-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine;2-[[2-[4-(trifluoromethyl)anilino]-6-[2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-4-pyridinyl]amino]ethanol.

Molecular Properties

• Compound Name: N-[4-(difluoromethoxy)phenyl]-6-(2-methylindol-1-yl)pyrazin-2-amine;4-N-(2-methoxyethyl)-6-[2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-2-N-[4-(trifluoromethyl)phenyl]pyridine-2,4-diamine;6-(2-methylindol-1-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine;2-[[2-[4-(trifluoromethyl)anilino]-6-[2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-4-pyridinyl]amino]ethanol
• PubChem CID: 159592155
• Molecular Formula: C85H67F17N18O3
• Molecular Weight: 1711.56 g/mol
• Exact Mass: 1710.54
• IUPAC Name: N-[4-(difluoromethoxy)phenyl]-6-(2-methylindol-1-yl)pyrazin-2-amine;4-N-(2-methoxyethyl)-6-[2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-2-N-[4-(trifluoromethyl)phenyl]pyridine-2,4-diamine;6-(2-methylindol-1-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine;2-[[2-[4-(trifluoromethyl)anilino]-6-[2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-4-pyridinyl]amino]ethanol
• SMILES: COCCNc1cc(Nc2ccc(C(F)(F)F)cc2)nc(-c2c(C(F)(F)F)nc3ccccn23)c1.Cc1cc2ccccc2n1-c1cncc(Nc2ccc(C(F)(F)F)cc2)n1.Cc1cc2ccccc2n1-c1cncc(Nc2ccc(OC(F)F)cc2)n1.OCCNc1cc(Nc2ccc(C(F)(F)F)cc2)nc(-c2c(C(F)(F)F)nc3ccccn23)c1
• InChI: InChI=1S/C23H19F6N5O.C22H17F6N5O.C20H15F3N4.C20H16F2N4O/c1-35-11-9-30-16-12-17(20-21(23(27,28)29)33-19-4-2-3-10-34(19)20)32-18(13-16)31-15-7-5-14(6-8-15)22(24,25)26;23-21(24,25)13-4-6-14(7-5-13)30-17-12-15(29-8-10-34)11-16(31-17)19-20(22(26,27)28)32-18-3-1-2-9-33(18)19;1-13-10-14-4-2-3-5-17(14)27(13)19-12-24-11-18(26-19)25-16-8-6-15(7-9-16)20(21,22)23;1-13-10-14-4-2-3-5-17(14)26(13)19-12-23-11-18(25-19)24-15-6-8-16(9-7-15)27-20(21)22/h2-8,10,12-13H,9,11H2,1H3,(H2,30,31,32);1-7,9,11-12,34H,8,10H2,(H2,29,30,31);2-12H,1H3,(H,25,26);2-12,20H,1H3,(H,24,25)
• InChIKey: MKJLURXSCLJMOZ-UHFFFAOYSA-N
• XLogP: 22.38
• TPSA: 232.67 Ų
• H-Bond Donors: 7
• H-Bond Acceptors: 21
• Rotatable Bonds: 21
• Heavy Atoms: 123
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1711.56
LogP ≤ 5	22.38
H-Bond Donors ≤ 5	7
H-Bond Acceptors ≤ 10	21

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of N-[4-(difluoromethoxy)phenyl]-6-(2-methylindol-1-yl)pyrazin-2-amine;4-N-(2-methoxyethyl)-6-[2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-2-N-[4-(trifluoromethyl)phenyl]pyridine-2,4-diamine;6-(2-methylindol-1-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine;2-[[2-[4-(trifluoromethyl)anilino]-6-[2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-4-pyridinyl]amino]ethanol?

The IUPAC name of N-[4-(difluoromethoxy)phenyl]-6-(2-methylindol-1-yl)pyrazin-2-amine;4-N-(2-methoxyethyl)-6-[2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-2-N-[4-(trifluoromethyl)phenyl]pyridine-2,4-diamine;6-(2-methylindol-1-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine;2-[[2-[4-(trifluoromethyl)anilino]-6-[2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-4-pyridinyl]amino]ethanol (CID 159592155) is N-[4-(difluoromethoxy)phenyl]-6-(2-methylindol-1-yl)pyrazin-2-amine;4-N-(2-methoxyethyl)-6-[2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-2-N-[4-(trifluoromethyl)phenyl]pyridine-2,4-diamine;6-(2-methylindol-1-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine;2-[[2-[4-(trifluoromethyl)anilino]-6-[2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-4-pyridinyl]amino]ethanol.

What is the SMILES notation for N-[4-(difluoromethoxy)phenyl]-6-(2-methylindol-1-yl)pyrazin-2-amine;4-N-(2-methoxyethyl)-6-[2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-2-N-[4-(trifluoromethyl)phenyl]pyridine-2,4-diamine;6-(2-methylindol-1-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine;2-[[2-[4-(trifluoromethyl)anilino]-6-[2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-4-pyridinyl]amino]ethanol?

The canonical SMILES for N-[4-(difluoromethoxy)phenyl]-6-(2-methylindol-1-yl)pyrazin-2-amine;4-N-(2-methoxyethyl)-6-[2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-2-N-[4-(trifluoromethyl)phenyl]pyridine-2,4-diamine;6-(2-methylindol-1-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine;2-[[2-[4-(trifluoromethyl)anilino]-6-[2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-4-pyridinyl]amino]ethanol is COCCNc1cc(Nc2ccc(C(F)(F)F)cc2)nc(-c2c(C(F)(F)F)nc3ccccn23)c1.Cc1cc2ccccc2n1-c1cncc(Nc2ccc(C(F)(F)F)cc2)n1.Cc1cc2ccccc2n1-c1cncc(Nc2ccc(OC(F)F)cc2)n1.OCCNc1cc(Nc2ccc(C(F)(F)F)cc2)nc(-c2c(C(F)(F)F)nc3ccccn23)c1.

What is the InChIKey of N-[4-(difluoromethoxy)phenyl]-6-(2-methylindol-1-yl)pyrazin-2-amine;4-N-(2-methoxyethyl)-6-[2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-2-N-[4-(trifluoromethyl)phenyl]pyridine-2,4-diamine;6-(2-methylindol-1-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine;2-[[2-[4-(trifluoromethyl)anilino]-6-[2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-4-pyridinyl]amino]ethanol?

The InChIKey is MKJLURXSCLJMOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19F6N5O.C22H17F6N5O.C20H15F3N4.C20H16F2N4O/c1-35-11-9-30-16-12-17(20-21(23(27,28)29)33-19-4-2-3-10-34(19)20)32-18(13-16)31-15-7-5-14(6-8-15)22(24,25)26;23-21(24,25)13-4-6-14(7-5-13)30-17-12-15(29-8-10-34)11-16(31-17)19-20(22(26,27)28)32-18-3-1-2-9-33(18)19;1-13-10-14-4-2-3-5-17(14)27(13)19-12-24-11-18(26-19)25-16-8-6-15(7-9-16)20(21,22)23;1-13-10-14-4-2-3-5-17(14)26(13)19-12-23-11-18(25-19)24-15-6-8-16(9-7-15)27-20(21)22/h2-8,10,12-13H,9,11H2,1H3,(H2,30,31,32);1-7,9,11-12,34H,8,10H2,(H2,29,30,31);2-12H,1H3,(H,25,26);2-12,20H,1H3,(H,24,25).

What are the key properties of N-[4-(difluoromethoxy)phenyl]-6-(2-methylindol-1-yl)pyrazin-2-amine;4-N-(2-methoxyethyl)-6-[2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-2-N-[4-(trifluoromethyl)phenyl]pyridine-2,4-diamine;6-(2-methylindol-1-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine;2-[[2-[4-(trifluoromethyl)anilino]-6-[2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-4-pyridinyl]amino]ethanol?

N-[4-(difluoromethoxy)phenyl]-6-(2-methylindol-1-yl)pyrazin-2-amine;4-N-(2-methoxyethyl)-6-[2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-2-N-[4-(trifluoromethyl)phenyl]pyridine-2,4-diamine;6-(2-methylindol-1-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine;2-[[2-[4-(trifluoromethyl)anilino]-6-[2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-4-pyridinyl]amino]ethanol has a molecular weight of 1711.56 g/mol, XLogP of 22.38, 21 rotatable bonds, 7 hydrogen bond donors, and 21 hydrogen bond acceptors.

Where does this data come from?

All data for N-[4-(difluoromethoxy)phenyl]-6-(2-methylindol-1-yl)pyrazin-2-amine;4-N-(2-methoxyethyl)-6-[2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-2-N-[4-(trifluoromethyl)phenyl]pyridine-2,4-diamine;6-(2-methylindol-1-yl)-N-[4-(trifluoromethyl)phenyl]pyrazin-2-amine;2-[[2-[4-(trifluoromethyl)anilino]-6-[2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-4-pyridinyl]amino]ethanol is sourced from PubChem (CID 159592155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).