N-[(2,6-difluorophenyl)methyl]-5-(6-methyl-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl)pyridin-2-amine;N-[(2,6-difluorophenyl)methyl]-5-(6-methylspiro[2.4]hept-6-en-7-yl)pyridin-2-amine;N-[(2,6-difluorophenyl)methyl]-5-[6-(trifluoromethyl)-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl]pyrazin-2-amine;N-[(2,6-difluorophenyl)methyl]-5-[6-(trifluoromethyl)-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl]pyridin-2-amine;N-[(2-fluorophenyl)methyl]-5-[6-(trifluoromethyl)-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl]pyrazin-2-amine;N-(2-methylpropyl)-5-[6-(trifluoromethyl)-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl]pyrazin-2-amine

C124H130F21N15 — CID 158870294

About N-[(2,6-difluorophenyl)methyl]-5-(6-methyl-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl)pyridin-2-amine;N-[(2,6-difluorophenyl)methyl]-5-(6-methylspiro[2.4]hept-6-en-7-yl)pyridin-2-amine;N-[(2,6-difluorophenyl)methyl]-5-[6-(trifluoromethyl)-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl]pyrazin-2-amine;N-[(2,6-difluorophenyl)methyl]-5-[6-(trifluoromethyl)-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl]pyridin-2-amine;N-[(2-fluorophenyl)methyl]-5-[6-(trifluoromethyl)-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl]pyrazin-2-amine;N-(2-methylpropyl)-5-[6-(trifluoromethyl)-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl]pyrazin-2-amine

N-[(2,6-difluorophenyl)methyl]-5-(6-methyl-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl)pyridin-2-amine;N-[(2,6-difluorophenyl)methyl]-5-(6-methylspiro[2.4]hept-6-en-7-yl)pyridin-2-amine;N-[(2,6-difluorophenyl)methyl]-5-[6-(trifluoromethyl)-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl]pyrazin-2-amine;N-[(2,6-difluorophenyl)methyl]-5-[6-(trifluoromethyl)-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl]pyridin-2-amine;N-[(2-fluorophenyl)methyl]-5-[6-(trifluoromethyl)-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl]pyrazin-2-amine;N-(2-methylpropyl)-5-[6-(trifluoromethyl)-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl]pyrazin-2-amine (PubChem CID 158870294) has the molecular formula C124H130F21N15 and a molecular weight of 2229.47 g/mol. Its IUPAC name is N-[(2,6-difluorophenyl)methyl]-5-(6-methyl-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl)pyridin-2-amine;N-[(2,6-difluorophenyl)methyl]-5-(6-methylspiro[2.4]hept-6-en-7-yl)pyridin-2-amine;N-[(2,6-difluorophenyl)methyl]-5-[6-(trifluoromethyl)-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl]pyrazin-2-amine;N-[(2,6-difluorophenyl)methyl]-5-[6-(trifluoromethyl)-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl]pyridin-2-amine;N-[(2-fluorophenyl)methyl]-5-[6-(trifluoromethyl)-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl]pyrazin-2-amine;N-(2-methylpropyl)-5-[6-(trifluoromethyl)-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl]pyrazin-2-amine.

Molecular Properties

• Compound Name: N-[(2,6-difluorophenyl)methyl]-5-(6-methyl-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl)pyridin-2-amine;N-[(2,6-difluorophenyl)methyl]-5-(6-methylspiro[2.4]hept-6-en-7-yl)pyridin-2-amine;N-[(2,6-difluorophenyl)methyl]-5-[6-(trifluoromethyl)-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl]pyrazin-2-amine;N-[(2,6-difluorophenyl)methyl]-5-[6-(trifluoromethyl)-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl]pyridin-2-amine;N-[(2-fluorophenyl)methyl]-5-[6-(trifluoromethyl)-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl]pyrazin-2-amine;N-(2-methylpropyl)-5-[6-(trifluoromethyl)-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl]pyrazin-2-amine
• PubChem CID: 158870294
• Molecular Formula: C124H130F21N15
• Molecular Weight: 2229.47 g/mol
• Exact Mass: 2228.03
• IUPAC Name: N-[(2,6-difluorophenyl)methyl]-5-(6-methyl-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl)pyridin-2-amine;N-[(2,6-difluorophenyl)methyl]-5-(6-methylspiro[2.4]hept-6-en-7-yl)pyridin-2-amine;N-[(2,6-difluorophenyl)methyl]-5-[6-(trifluoromethyl)-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl]pyrazin-2-amine;N-[(2,6-difluorophenyl)methyl]-5-[6-(trifluoromethyl)-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl]pyridin-2-amine;N-[(2-fluorophenyl)methyl]-5-[6-(trifluoromethyl)-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl]pyrazin-2-amine;N-(2-methylpropyl)-5-[6-(trifluoromethyl)-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl]pyrazin-2-amine
• SMILES: CC(C)CNc1cnc(C2=C(C(F)(F)F)CC3CCCC3C2)cn1.CC1=C(c2ccc(NCc3c(F)cccc3F)nc2)C2(CC1)CC2.CC1=C(c2ccc(NCc3c(F)cccc3F)nc2)CC2CCCC2C1.Fc1cccc(F)c1CNc1ccc(C2=C(C(F)(F)F)CC3CCCC3C2)cn1.Fc1cccc(F)c1CNc1cnc(C2=C(C(F)(F)F)CC3CCCC3C2)cn1.Fc1ccccc1CNc1cnc(C2=C(C(F)(F)F)CC3CCCC3C2)cn1
• InChI: InChI=1S/C22H21F5N2.C22H24F2N2.C21H20F5N3.C21H21F4N3.C20H20F2N2.C18H24F3N3/c23-19-5-2-6-20(24)17(19)12-29-21-8-7-15(11-28-21)16-9-13-3-1-4-14(13)10-18(16)22(25,26)27;1-14-10-15-4-2-5-16(15)11-18(14)17-8-9-22(25-12-17)26-13-19-20(23)6-3-7-21(19)24;22-17-5-2-6-18(23)15(17)9-28-20-11-27-19(10-29-20)14-7-12-3-1-4-13(12)8-16(14)21(24,25)26;22-18-7-2-1-4-15(18)10-27-20-12-26-19(11-28-20)16-8-13-5-3-6-14(13)9-17(16)21(23,24)25;1-13-7-8-20(9-10-20)19(13)14-5-6-18(23-11-14)24-12-15-16(21)3-2-4-17(15)22;1-11(2)8-23-17-10-22-16(9-24-17)14-6-12-4-3-5-13(12)7-15(14)18(19,20)21/h2,5-8,11,13-14H,1,3-4,9-10,12H2,(H,28,29);3,6-9,12,15-16H,2,4-5,10-11,13H2,1H3,(H,25,26);2,5-6,10-13H,1,3-4,7-9H2,(H,28,29);1-2,4,7,11-14H,3,5-6,8-10H2,(H,27,28);2-6,11H,7-10,12H2,1H3,(H,23,24);9-13H,3-8H2,1-2H3,(H,23,24)
• InChIKey: JBTIHBYQEBUJAI-UHFFFAOYSA-N
• XLogP: 34.49
• TPSA: 188.19 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 15
• Rotatable Bonds: 24
• Heavy Atoms: 160
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2229.47
LogP ≤ 5	34.49
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	15

Frequently Asked Questions

What is the IUPAC name of N-[(2,6-difluorophenyl)methyl]-5-(6-methyl-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl)pyridin-2-amine;N-[(2,6-difluorophenyl)methyl]-5-(6-methylspiro[2.4]hept-6-en-7-yl)pyridin-2-amine;N-[(2,6-difluorophenyl)methyl]-5-[6-(trifluoromethyl)-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl]pyrazin-2-amine;N-[(2,6-difluorophenyl)methyl]-5-[6-(trifluoromethyl)-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl]pyridin-2-amine;N-[(2-fluorophenyl)methyl]-5-[6-(trifluoromethyl)-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl]pyrazin-2-amine;N-(2-methylpropyl)-5-[6-(trifluoromethyl)-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl]pyrazin-2-amine?

The IUPAC name of N-[(2,6-difluorophenyl)methyl]-5-(6-methyl-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl)pyridin-2-amine;N-[(2,6-difluorophenyl)methyl]-5-(6-methylspiro[2.4]hept-6-en-7-yl)pyridin-2-amine;N-[(2,6-difluorophenyl)methyl]-5-[6-(trifluoromethyl)-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl]pyrazin-2-amine;N-[(2,6-difluorophenyl)methyl]-5-[6-(trifluoromethyl)-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl]pyridin-2-amine;N-[(2-fluorophenyl)methyl]-5-[6-(trifluoromethyl)-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl]pyrazin-2-amine;N-(2-methylpropyl)-5-[6-(trifluoromethyl)-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl]pyrazin-2-amine (CID 158870294) is N-[(2,6-difluorophenyl)methyl]-5-(6-methyl-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl)pyridin-2-amine;N-[(2,6-difluorophenyl)methyl]-5-(6-methylspiro[2.4]hept-6-en-7-yl)pyridin-2-amine;N-[(2,6-difluorophenyl)methyl]-5-[6-(trifluoromethyl)-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl]pyrazin-2-amine;N-[(2,6-difluorophenyl)methyl]-5-[6-(trifluoromethyl)-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl]pyridin-2-amine;N-[(2-fluorophenyl)methyl]-5-[6-(trifluoromethyl)-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl]pyrazin-2-amine;N-(2-methylpropyl)-5-[6-(trifluoromethyl)-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl]pyrazin-2-amine.

What is the SMILES notation for N-[(2,6-difluorophenyl)methyl]-5-(6-methyl-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl)pyridin-2-amine;N-[(2,6-difluorophenyl)methyl]-5-(6-methylspiro[2.4]hept-6-en-7-yl)pyridin-2-amine;N-[(2,6-difluorophenyl)methyl]-5-[6-(trifluoromethyl)-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl]pyrazin-2-amine;N-[(2,6-difluorophenyl)methyl]-5-[6-(trifluoromethyl)-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl]pyridin-2-amine;N-[(2-fluorophenyl)methyl]-5-[6-(trifluoromethyl)-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl]pyrazin-2-amine;N-(2-methylpropyl)-5-[6-(trifluoromethyl)-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl]pyrazin-2-amine?

The canonical SMILES for N-[(2,6-difluorophenyl)methyl]-5-(6-methyl-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl)pyridin-2-amine;N-[(2,6-difluorophenyl)methyl]-5-(6-methylspiro[2.4]hept-6-en-7-yl)pyridin-2-amine;N-[(2,6-difluorophenyl)methyl]-5-[6-(trifluoromethyl)-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl]pyrazin-2-amine;N-[(2,6-difluorophenyl)methyl]-5-[6-(trifluoromethyl)-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl]pyridin-2-amine;N-[(2-fluorophenyl)methyl]-5-[6-(trifluoromethyl)-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl]pyrazin-2-amine;N-(2-methylpropyl)-5-[6-(trifluoromethyl)-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl]pyrazin-2-amine is CC(C)CNc1cnc(C2=C(C(F)(F)F)CC3CCCC3C2)cn1.CC1=C(c2ccc(NCc3c(F)cccc3F)nc2)C2(CC1)CC2.CC1=C(c2ccc(NCc3c(F)cccc3F)nc2)CC2CCCC2C1.Fc1cccc(F)c1CNc1ccc(C2=C(C(F)(F)F)CC3CCCC3C2)cn1.Fc1cccc(F)c1CNc1cnc(C2=C(C(F)(F)F)CC3CCCC3C2)cn1.Fc1ccccc1CNc1cnc(C2=C(C(F)(F)F)CC3CCCC3C2)cn1.

What is the InChIKey of N-[(2,6-difluorophenyl)methyl]-5-(6-methyl-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl)pyridin-2-amine;N-[(2,6-difluorophenyl)methyl]-5-(6-methylspiro[2.4]hept-6-en-7-yl)pyridin-2-amine;N-[(2,6-difluorophenyl)methyl]-5-[6-(trifluoromethyl)-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl]pyrazin-2-amine;N-[(2,6-difluorophenyl)methyl]-5-[6-(trifluoromethyl)-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl]pyridin-2-amine;N-[(2-fluorophenyl)methyl]-5-[6-(trifluoromethyl)-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl]pyrazin-2-amine;N-(2-methylpropyl)-5-[6-(trifluoromethyl)-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl]pyrazin-2-amine?

The InChIKey is JBTIHBYQEBUJAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21F5N2.C22H24F2N2.C21H20F5N3.C21H21F4N3.C20H20F2N2.C18H24F3N3/c23-19-5-2-6-20(24)17(19)12-29-21-8-7-15(11-28-21)16-9-13-3-1-4-14(13)10-18(16)22(25,26)27;1-14-10-15-4-2-5-16(15)11-18(14)17-8-9-22(25-12-17)26-13-19-20(23)6-3-7-21(19)24;22-17-5-2-6-18(23)15(17)9-28-20-11-27-19(10-29-20)14-7-12-3-1-4-13(12)8-16(14)21(24,25)26;22-18-7-2-1-4-15(18)10-27-20-12-26-19(11-28-20)16-8-13-5-3-6-14(13)9-17(16)21(23,24)25;1-13-7-8-20(9-10-20)19(13)14-5-6-18(23-11-14)24-12-15-16(21)3-2-4-17(15)22;1-11(2)8-23-17-10-22-16(9-24-17)14-6-12-4-3-5-13(12)7-15(14)18(19,20)21/h2,5-8,11,13-14H,1,3-4,9-10,12H2,(H,28,29);3,6-9,12,15-16H,2,4-5,10-11,13H2,1H3,(H,25,26);2,5-6,10-13H,1,3-4,7-9H2,(H,28,29);1-2,4,7,11-14H,3,5-6,8-10H2,(H,27,28);2-6,11H,7-10,12H2,1H3,(H,23,24);9-13H,3-8H2,1-2H3,(H,23,24).

What are the key properties of N-[(2,6-difluorophenyl)methyl]-5-(6-methyl-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl)pyridin-2-amine;N-[(2,6-difluorophenyl)methyl]-5-(6-methylspiro[2.4]hept-6-en-7-yl)pyridin-2-amine;N-[(2,6-difluorophenyl)methyl]-5-[6-(trifluoromethyl)-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl]pyrazin-2-amine;N-[(2,6-difluorophenyl)methyl]-5-[6-(trifluoromethyl)-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl]pyridin-2-amine;N-[(2-fluorophenyl)methyl]-5-[6-(trifluoromethyl)-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl]pyrazin-2-amine;N-(2-methylpropyl)-5-[6-(trifluoromethyl)-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl]pyrazin-2-amine?

N-[(2,6-difluorophenyl)methyl]-5-(6-methyl-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl)pyridin-2-amine;N-[(2,6-difluorophenyl)methyl]-5-(6-methylspiro[2.4]hept-6-en-7-yl)pyridin-2-amine;N-[(2,6-difluorophenyl)methyl]-5-[6-(trifluoromethyl)-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl]pyrazin-2-amine;N-[(2,6-difluorophenyl)methyl]-5-[6-(trifluoromethyl)-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl]pyridin-2-amine;N-[(2-fluorophenyl)methyl]-5-[6-(trifluoromethyl)-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl]pyrazin-2-amine;N-(2-methylpropyl)-5-[6-(trifluoromethyl)-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl]pyrazin-2-amine has a molecular weight of 2229.47 g/mol, XLogP of 34.49, 24 rotatable bonds, 6 hydrogen bond donors, and 15 hydrogen bond acceptors.

Where does this data come from?

All data for N-[(2,6-difluorophenyl)methyl]-5-(6-methyl-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl)pyridin-2-amine;N-[(2,6-difluorophenyl)methyl]-5-(6-methylspiro[2.4]hept-6-en-7-yl)pyridin-2-amine;N-[(2,6-difluorophenyl)methyl]-5-[6-(trifluoromethyl)-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl]pyrazin-2-amine;N-[(2,6-difluorophenyl)methyl]-5-[6-(trifluoromethyl)-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl]pyridin-2-amine;N-[(2-fluorophenyl)methyl]-5-[6-(trifluoromethyl)-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl]pyrazin-2-amine;N-(2-methylpropyl)-5-[6-(trifluoromethyl)-2,3,3a,4,7,7a-hexahydro-1H-inden-5-yl]pyrazin-2-amine is sourced from PubChem (CID 158870294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).