6-(3-chloro-4-pyridinyl)-7-(difluoromethyl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;7-(difluoromethyl)-6-(1,3-dimethylpyrazol-4-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;7-(difluoromethyl)-6-(1,5-dimethylpyrazol-3-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;7-(difluoromethyl)-6-(1,5-dimethylpyrazol-4-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;7-(difluoromethyl)-6-(2-methyl-4-pyridinyl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;4-[7-(difluoromethyl)-1-propan-2-yl-3,4-dihydro-2H-quinolin-6-yl]-1-methylpyridin-2-one;4-[7-(difluoromethyl)-1-propan-2-yl-3,4-dihydro-2H-quinolin-6-yl]pyridine-2-carbonitrile

C129H151ClF14N18O — CID 158597076

About 6-(3-chloro-4-pyridinyl)-7-(difluoromethyl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;7-(difluoromethyl)-6-(1,3-dimethylpyrazol-4-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;7-(difluoromethyl)-6-(1,5-dimethylpyrazol-3-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;7-(difluoromethyl)-6-(1,5-dimethylpyrazol-4-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;7-(difluoromethyl)-6-(2-methyl-4-pyridinyl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;4-[7-(difluoromethyl)-1-propan-2-yl-3,4-dihydro-2H-quinolin-6-yl]-1-methylpyridin-2-one;4-[7-(difluoromethyl)-1-propan-2-yl-3,4-dihydro-2H-quinolin-6-yl]pyridine-2-carbonitrile

6-(3-chloro-4-pyridinyl)-7-(difluoromethyl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;7-(difluoromethyl)-6-(1,3-dimethylpyrazol-4-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;7-(difluoromethyl)-6-(1,5-dimethylpyrazol-3-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;7-(difluoromethyl)-6-(1,5-dimethylpyrazol-4-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;7-(difluoromethyl)-6-(2-methyl-4-pyridinyl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;4-[7-(difluoromethyl)-1-propan-2-yl-3,4-dihydro-2H-quinolin-6-yl]-1-methylpyridin-2-one;4-[7-(difluoromethyl)-1-propan-2-yl-3,4-dihydro-2H-quinolin-6-yl]pyridine-2-carbonitrile (PubChem CID 158597076) has the molecular formula C129H151ClF14N18O and a molecular weight of 2271.18 g/mol. Its IUPAC name is 6-(3-chloro-4-pyridinyl)-7-(difluoromethyl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;7-(difluoromethyl)-6-(1,3-dimethylpyrazol-4-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;7-(difluoromethyl)-6-(1,5-dimethylpyrazol-3-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;7-(difluoromethyl)-6-(1,5-dimethylpyrazol-4-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;7-(difluoromethyl)-6-(2-methyl-4-pyridinyl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;4-[7-(difluoromethyl)-1-propan-2-yl-3,4-dihydro-2H-quinolin-6-yl]-1-methylpyridin-2-one;4-[7-(difluoromethyl)-1-propan-2-yl-3,4-dihydro-2H-quinolin-6-yl]pyridine-2-carbonitrile.

Molecular Properties

• Compound Name: 6-(3-chloro-4-pyridinyl)-7-(difluoromethyl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;7-(difluoromethyl)-6-(1,3-dimethylpyrazol-4-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;7-(difluoromethyl)-6-(1,5-dimethylpyrazol-3-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;7-(difluoromethyl)-6-(1,5-dimethylpyrazol-4-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;7-(difluoromethyl)-6-(2-methyl-4-pyridinyl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;4-[7-(difluoromethyl)-1-propan-2-yl-3,4-dihydro-2H-quinolin-6-yl]-1-methylpyridin-2-one;4-[7-(difluoromethyl)-1-propan-2-yl-3,4-dihydro-2H-quinolin-6-yl]pyridine-2-carbonitrile
• PubChem CID: 158597076
• Molecular Formula: C129H151ClF14N18O
• Molecular Weight: 2271.18 g/mol
• Exact Mass: 2269.18
• IUPAC Name: 6-(3-chloro-4-pyridinyl)-7-(difluoromethyl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;7-(difluoromethyl)-6-(1,3-dimethylpyrazol-4-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;7-(difluoromethyl)-6-(1,5-dimethylpyrazol-3-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;7-(difluoromethyl)-6-(1,5-dimethylpyrazol-4-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;7-(difluoromethyl)-6-(2-methyl-4-pyridinyl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;4-[7-(difluoromethyl)-1-propan-2-yl-3,4-dihydro-2H-quinolin-6-yl]-1-methylpyridin-2-one;4-[7-(difluoromethyl)-1-propan-2-yl-3,4-dihydro-2H-quinolin-6-yl]pyridine-2-carbonitrile
• SMILES: CC(C)N1CCCc2cc(-c3ccn(C)c(=O)c3)c(C(F)F)cc21.CC(C)N1CCCc2cc(-c3ccnc(C#N)c3)c(C(F)F)cc21.CC(C)N1CCCc2cc(-c3ccncc3Cl)c(C(F)F)cc21.Cc1c(-c2cc3c(cc2C(F)F)N(C(C)C)CCC3)cnn1C.Cc1cc(-c2cc3c(cc2C(F)F)N(C(C)C)CCC3)ccn1.Cc1cc(-c2cc3c(cc2C(F)F)N(C(C)C)CCC3)nn1C.Cc1nn(C)cc1-c1cc2c(cc1C(F)F)N(C(C)C)CCC2
• InChI: InChI=1S/C19H19F2N3.C19H22F2N2O.C19H22F2N2.C18H19ClF2N2.3C18H23F2N3/c1-12(2)24-7-3-4-14-9-16(17(19(20)21)10-18(14)24)13-5-6-23-15(8-13)11-22;1-12(2)23-7-4-5-14-9-15(16(19(20)21)11-17(14)23)13-6-8-22(3)18(24)10-13;1-12(2)23-8-4-5-15-10-16(14-6-7-22-13(3)9-14)17(19(20)21)11-18(15)23;1-11(2)23-7-3-4-12-8-14(13-5-6-22-10-16(13)19)15(18(20)21)9-17(12)23;1-11(2)23-7-5-6-13-8-14(15(18(19)20)9-17(13)23)16-10-22(4)21-12(16)3;1-11(2)23-7-5-6-13-8-14(15(18(19)20)9-17(13)23)16-10-21-22(4)12(16)3;1-11(2)23-7-5-6-13-9-14(15(18(19)20)10-17(13)23)16-8-12(3)22(4)21-16/h5-6,8-10,12,19H,3-4,7H2,1-2H3;6,8-12,19H,4-5,7H2,1-3H3;6-7,9-12,19H,4-5,8H2,1-3H3;5-6,8-11,18H,3-4,7H2,1-2H3;3*8-11,18H,5-7H2,1-4H3
• InChIKey: HVDZJWALVPICMI-UHFFFAOYSA-N
• XLogP: 33.01
• TPSA: 160.60 Ų
• H-Bond Acceptors: 19
• Rotatable Bonds: 21
• Heavy Atoms: 163
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2271.18
LogP ≤ 5	33.01
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	19

Frequently Asked Questions

What is the IUPAC name of 6-(3-chloro-4-pyridinyl)-7-(difluoromethyl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;7-(difluoromethyl)-6-(1,3-dimethylpyrazol-4-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;7-(difluoromethyl)-6-(1,5-dimethylpyrazol-3-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;7-(difluoromethyl)-6-(1,5-dimethylpyrazol-4-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;7-(difluoromethyl)-6-(2-methyl-4-pyridinyl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;4-[7-(difluoromethyl)-1-propan-2-yl-3,4-dihydro-2H-quinolin-6-yl]-1-methylpyridin-2-one;4-[7-(difluoromethyl)-1-propan-2-yl-3,4-dihydro-2H-quinolin-6-yl]pyridine-2-carbonitrile?

The IUPAC name of 6-(3-chloro-4-pyridinyl)-7-(difluoromethyl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;7-(difluoromethyl)-6-(1,3-dimethylpyrazol-4-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;7-(difluoromethyl)-6-(1,5-dimethylpyrazol-3-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;7-(difluoromethyl)-6-(1,5-dimethylpyrazol-4-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;7-(difluoromethyl)-6-(2-methyl-4-pyridinyl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;4-[7-(difluoromethyl)-1-propan-2-yl-3,4-dihydro-2H-quinolin-6-yl]-1-methylpyridin-2-one;4-[7-(difluoromethyl)-1-propan-2-yl-3,4-dihydro-2H-quinolin-6-yl]pyridine-2-carbonitrile (CID 158597076) is 6-(3-chloro-4-pyridinyl)-7-(difluoromethyl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;7-(difluoromethyl)-6-(1,3-dimethylpyrazol-4-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;7-(difluoromethyl)-6-(1,5-dimethylpyrazol-3-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;7-(difluoromethyl)-6-(1,5-dimethylpyrazol-4-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;7-(difluoromethyl)-6-(2-methyl-4-pyridinyl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;4-[7-(difluoromethyl)-1-propan-2-yl-3,4-dihydro-2H-quinolin-6-yl]-1-methylpyridin-2-one;4-[7-(difluoromethyl)-1-propan-2-yl-3,4-dihydro-2H-quinolin-6-yl]pyridine-2-carbonitrile.

What is the SMILES notation for 6-(3-chloro-4-pyridinyl)-7-(difluoromethyl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;7-(difluoromethyl)-6-(1,3-dimethylpyrazol-4-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;7-(difluoromethyl)-6-(1,5-dimethylpyrazol-3-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;7-(difluoromethyl)-6-(1,5-dimethylpyrazol-4-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;7-(difluoromethyl)-6-(2-methyl-4-pyridinyl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;4-[7-(difluoromethyl)-1-propan-2-yl-3,4-dihydro-2H-quinolin-6-yl]-1-methylpyridin-2-one;4-[7-(difluoromethyl)-1-propan-2-yl-3,4-dihydro-2H-quinolin-6-yl]pyridine-2-carbonitrile?

The canonical SMILES for 6-(3-chloro-4-pyridinyl)-7-(difluoromethyl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;7-(difluoromethyl)-6-(1,3-dimethylpyrazol-4-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;7-(difluoromethyl)-6-(1,5-dimethylpyrazol-3-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;7-(difluoromethyl)-6-(1,5-dimethylpyrazol-4-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;7-(difluoromethyl)-6-(2-methyl-4-pyridinyl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;4-[7-(difluoromethyl)-1-propan-2-yl-3,4-dihydro-2H-quinolin-6-yl]-1-methylpyridin-2-one;4-[7-(difluoromethyl)-1-propan-2-yl-3,4-dihydro-2H-quinolin-6-yl]pyridine-2-carbonitrile is CC(C)N1CCCc2cc(-c3ccn(C)c(=O)c3)c(C(F)F)cc21.CC(C)N1CCCc2cc(-c3ccnc(C#N)c3)c(C(F)F)cc21.CC(C)N1CCCc2cc(-c3ccncc3Cl)c(C(F)F)cc21.Cc1c(-c2cc3c(cc2C(F)F)N(C(C)C)CCC3)cnn1C.Cc1cc(-c2cc3c(cc2C(F)F)N(C(C)C)CCC3)ccn1.Cc1cc(-c2cc3c(cc2C(F)F)N(C(C)C)CCC3)nn1C.Cc1nn(C)cc1-c1cc2c(cc1C(F)F)N(C(C)C)CCC2.

What is the InChIKey of 6-(3-chloro-4-pyridinyl)-7-(difluoromethyl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;7-(difluoromethyl)-6-(1,3-dimethylpyrazol-4-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;7-(difluoromethyl)-6-(1,5-dimethylpyrazol-3-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;7-(difluoromethyl)-6-(1,5-dimethylpyrazol-4-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;7-(difluoromethyl)-6-(2-methyl-4-pyridinyl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;4-[7-(difluoromethyl)-1-propan-2-yl-3,4-dihydro-2H-quinolin-6-yl]-1-methylpyridin-2-one;4-[7-(difluoromethyl)-1-propan-2-yl-3,4-dihydro-2H-quinolin-6-yl]pyridine-2-carbonitrile?

The InChIKey is HVDZJWALVPICMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19F2N3.C19H22F2N2O.C19H22F2N2.C18H19ClF2N2.3C18H23F2N3/c1-12(2)24-7-3-4-14-9-16(17(19(20)21)10-18(14)24)13-5-6-23-15(8-13)11-22;1-12(2)23-7-4-5-14-9-15(16(19(20)21)11-17(14)23)13-6-8-22(3)18(24)10-13;1-12(2)23-8-4-5-15-10-16(14-6-7-22-13(3)9-14)17(19(20)21)11-18(15)23;1-11(2)23-7-3-4-12-8-14(13-5-6-22-10-16(13)19)15(18(20)21)9-17(12)23;1-11(2)23-7-5-6-13-8-14(15(18(19)20)9-17(13)23)16-10-22(4)21-12(16)3;1-11(2)23-7-5-6-13-8-14(15(18(19)20)9-17(13)23)16-10-21-22(4)12(16)3;1-11(2)23-7-5-6-13-9-14(15(18(19)20)10-17(13)23)16-8-12(3)22(4)21-16/h5-6,8-10,12,19H,3-4,7H2,1-2H3;6,8-12,19H,4-5,7H2,1-3H3;6-7,9-12,19H,4-5,8H2,1-3H3;5-6,8-11,18H,3-4,7H2,1-2H3;3*8-11,18H,5-7H2,1-4H3.

What are the key properties of 6-(3-chloro-4-pyridinyl)-7-(difluoromethyl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;7-(difluoromethyl)-6-(1,3-dimethylpyrazol-4-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;7-(difluoromethyl)-6-(1,5-dimethylpyrazol-3-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;7-(difluoromethyl)-6-(1,5-dimethylpyrazol-4-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;7-(difluoromethyl)-6-(2-methyl-4-pyridinyl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;4-[7-(difluoromethyl)-1-propan-2-yl-3,4-dihydro-2H-quinolin-6-yl]-1-methylpyridin-2-one;4-[7-(difluoromethyl)-1-propan-2-yl-3,4-dihydro-2H-quinolin-6-yl]pyridine-2-carbonitrile?

6-(3-chloro-4-pyridinyl)-7-(difluoromethyl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;7-(difluoromethyl)-6-(1,3-dimethylpyrazol-4-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;7-(difluoromethyl)-6-(1,5-dimethylpyrazol-3-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;7-(difluoromethyl)-6-(1,5-dimethylpyrazol-4-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;7-(difluoromethyl)-6-(2-methyl-4-pyridinyl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;4-[7-(difluoromethyl)-1-propan-2-yl-3,4-dihydro-2H-quinolin-6-yl]-1-methylpyridin-2-one;4-[7-(difluoromethyl)-1-propan-2-yl-3,4-dihydro-2H-quinolin-6-yl]pyridine-2-carbonitrile has a molecular weight of 2271.18 g/mol, XLogP of 33.01, 21 rotatable bonds, 0 hydrogen bond donors, and 19 hydrogen bond acceptors.

Where does this data come from?

All data for 6-(3-chloro-4-pyridinyl)-7-(difluoromethyl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;7-(difluoromethyl)-6-(1,3-dimethylpyrazol-4-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;7-(difluoromethyl)-6-(1,5-dimethylpyrazol-3-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;7-(difluoromethyl)-6-(1,5-dimethylpyrazol-4-yl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;7-(difluoromethyl)-6-(2-methyl-4-pyridinyl)-1-propan-2-yl-3,4-dihydro-2H-quinoline;4-[7-(difluoromethyl)-1-propan-2-yl-3,4-dihydro-2H-quinolin-6-yl]-1-methylpyridin-2-one;4-[7-(difluoromethyl)-1-propan-2-yl-3,4-dihydro-2H-quinolin-6-yl]pyridine-2-carbonitrile is sourced from PubChem (CID 158597076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).