4-chloro-5,7-difluoro-3-methyl-2-(4-methyl-2-pyridinyl)quinoline;5,7-difluoro-N-[5-(3-fluoro-4-propan-2-yloxyphenyl)-2-morpholin-4-yl-4-pyridinyl]-3-methyl-2-(4-methyl-2-pyridinyl)quinolin-4-amine;5-(3-fluoro-4-propan-2-yloxyphenyl)-2-morpholin-4-ylpyridin-4-amine

C68H65ClF6N10O4 — CID 159629113

IUPAC4-chloro-5,7-difluoro-3-methyl-2-(4-methyl-2-pyridinyl)quinoline;5,7-difluoro-N-[5-(3-fluoro-4-propan-2-yloxyphenyl)-2-morpholin-4-yl-4-pyridinyl]-3-methyl-2-(4-methyl-2-pyridinyl)quinolin-4-amine;5-(3-fluoro-4-propan-2-yloxyphenyl)-2-morpholin-4-ylpyridin-4-amine
SMILESCC(C)Oc1ccc(-c2cnc(N3CCOCC3)cc2N)cc1F.Cc1ccnc(-c2nc3cc(F)cc(F)c3c(Cl)c2C)c1.Cc1ccnc(-c2nc3cc(F)cc(F)c3c(Nc3cc(N4CCOCC4)ncc3-c3ccc(OC(C)C)c(F)c3)c2C)c1
InChIInChI=1S/C34H32F3N5O2.C18H22FN3O2.C16H11ClF2N2/c1-19(2)44-30-6-5-22(14-25(30)36)24-18-39-31(42-9-11-43-12-10-42)17-27(24)40-34-21(4)33(29-13-20(3)7-8-38-29)41-28-16-23(35)15-26(37)32(28)34;1-12(2)24-17-4-3-13(9-15(17)19)14-11-21-18(10-16(14)20)22-5-7-23-8-6-22;1-8-3-4-20-13(5-8)16-9(2)15(17)14-11(19)6-10(18)7-12(14)21-16/h5-8,13-19H,9-12H2,1-4H3,(H,39,40,41);3-4,9-12H,5-8H2,1-2H3,(H2,20,21);3-7H,1-2H3
InChIKeyMOWRTIQLSNIGRE-UHFFFAOYSA-N
MW1235.77 g/mol
LogP15.70
Rot. Bonds12

About 4-chloro-5,7-difluoro-3-methyl-2-(4-methyl-2-pyridinyl)quinoline;5,7-difluoro-N-[5-(3-fluoro-4-propan-2-yloxyphenyl)-2-morpholin-4-yl-4-pyridinyl]-3-methyl-2-(4-methyl-2-pyridinyl)quinolin-4-amine;5-(3-fluoro-4-propan-2-yloxyphenyl)-2-morpholin-4-ylpyridin-4-amine

4-chloro-5,7-difluoro-3-methyl-2-(4-methyl-2-pyridinyl)quinoline;5,7-difluoro-N-[5-(3-fluoro-4-propan-2-yloxyphenyl)-2-morpholin-4-yl-4-pyridinyl]-3-methyl-2-(4-methyl-2-pyridinyl)quinolin-4-amine;5-(3-fluoro-4-propan-2-yloxyphenyl)-2-morpholin-4-ylpyridin-4-amine (PubChem CID 159629113) has the molecular formula C68H65ClF6N10O4 and a molecular weight of 1235.77 g/mol. Its IUPAC name is 4-chloro-5,7-difluoro-3-methyl-2-(4-methyl-2-pyridinyl)quinoline;5,7-difluoro-N-[5-(3-fluoro-4-propan-2-yloxyphenyl)-2-morpholin-4-yl-4-pyridinyl]-3-methyl-2-(4-methyl-2-pyridinyl)quinolin-4-amine;5-(3-fluoro-4-propan-2-yloxyphenyl)-2-morpholin-4-ylpyridin-4-amine.

Molecular Properties

Compound Name4-chloro-5,7-difluoro-3-methyl-2-(4-methyl-2-pyridinyl)quinoline;5,7-difluoro-N-[5-(3-fluoro-4-propan-2-yloxyphenyl)-2-morpholin-4-yl-4-pyridinyl]-3-methyl-2-(4-methyl-2-pyridinyl)quinolin-4-amine;5-(3-fluoro-4-propan-2-yloxyphenyl)-2-morpholin-4-ylpyridin-4-amine
PubChem CID159629113
Molecular FormulaC68H65ClF6N10O4
Molecular Weight1235.77 g/mol
Exact Mass1234.48
IUPAC Name4-chloro-5,7-difluoro-3-methyl-2-(4-methyl-2-pyridinyl)quinoline;5,7-difluoro-N-[5-(3-fluoro-4-propan-2-yloxyphenyl)-2-morpholin-4-yl-4-pyridinyl]-3-methyl-2-(4-methyl-2-pyridinyl)quinolin-4-amine;5-(3-fluoro-4-propan-2-yloxyphenyl)-2-morpholin-4-ylpyridin-4-amine
SMILESCC(C)Oc1ccc(-c2cnc(N3CCOCC3)cc2N)cc1F.Cc1ccnc(-c2nc3cc(F)cc(F)c3c(Cl)c2C)c1.Cc1ccnc(-c2nc3cc(F)cc(F)c3c(Nc3cc(N4CCOCC4)ncc3-c3ccc(OC(C)C)c(F)c3)c2C)c1
InChIInChI=1S/C34H32F3N5O2.C18H22FN3O2.C16H11ClF2N2/c1-19(2)44-30-6-5-22(14-25(30)36)24-18-39-31(42-9-11-43-12-10-42)17-27(24)40-34-21(4)33(29-13-20(3)7-8-38-29)41-28-16-23(35)15-26(37)32(28)34;1-12(2)24-17-4-3-13(9-15(17)19)14-11-21-18(10-16(14)20)22-5-7-23-8-6-22;1-8-3-4-20-13(5-8)16-9(2)15(17)14-11(19)6-10(18)7-12(14)21-16/h5-8,13-19H,9-12H2,1-4H3,(H,39,40,41);3-4,9-12H,5-8H2,1-2H3,(H2,20,21);3-7H,1-2H3
InChIKeyMOWRTIQLSNIGRE-UHFFFAOYSA-N
XLogP15.70
TPSA158.79 Ų
H-Bond Donors2
H-Bond Acceptors14
Rotatable Bonds12
Heavy Atoms89
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001235.77
LogP ≤ 515.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1014

Analyze 4-chloro-5,7-difluoro-3-methyl-2-(4-methyl-2-pyridinyl)quinoline;5,7-difluoro-N-[5-(3-fluoro-4-propan-2-yloxyphenyl)-2-morpholin-4-yl-4-pyridinyl]-3-methyl-2-(4-methyl-2-pyridinyl)quinolin-4-amine;5-(3-fluoro-4-propan-2-yloxyphenyl)-2-morpholin-4-ylpyridin-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-[3-[4-(quinolin-2-ylmethoxy)phenyl]-2-pyridinyl]-7,8-dihydro-5H-1,6-naphthyridine
CID 71455565
N-[3-chloro-4-[(3-fluorophenyl)methoxy]phenyl]-6-(5-methyl-6-morpholin-4-yl-3-pyridinyl)quinazolin-4-amine
CID 127035117
4-[4-(6-chloro-2-methoxyacridin-9-yl)piperazin-1-yl]-N-(4-fluorophenyl)pyrimidin-2-amine
CID 155812806
US20240116947, Example 55
CID 162441410
US20240116947, Example 42
CID 171419228
N-(2,5-di-4-morpholinyl-3-pyridinyl)-5,7-difluoro-2-(6-methoxy-2-pyridinyl)-3-methyl-4-quinolinamine
CID 50906572
2-(6-(cyclopropylmethoxy)-pyridin-3-yl)-N-(2,5-dimorpholinopyridin-3-yl)-5,7-difluoro-3-methylquinolin-4-amine
CID 50908277
5,7-difluoro-N-(5-(5-methoxypyridin-3-yl)-2-morpholinopyrimidin-4-yl)-3-methyl-2-(pyridin-2-yl)quinolin-4-amine
CID 56591563
N-(5-(4-(difluoromethoxy)phenyl)-2-morpholinopyrimidin-4-yl)-5,7-difluoro-3-methyl-2-(pyridin-2-yl)quinolin-4-amine
CID 56591564
N-(5-(4-(difluoromethoxy)phenyl)-2-morpholinopyrimidin-4-yl)-5-fluoro-3-methyl-2-(pyridin-2-yl)quinolin-4-amine
CID 56591658
5,7-difluoro-N-(5'-fluoro-6'-methoxy-6-morpholino-3,3'-bipyridin-4-yl)-3-methyl-2-(pyridin-2-yl)-quinolin-4-amine
CID 56597849
5,7-difluoro-3-methyl-N-(2-morpholino-5-(4-(trifluoromethoxy)phenyl)pyridin-4-yl)-2-(pyridin-2-yl)-quinolin-4-amine
CID 56597983

Frequently Asked Questions

What is the IUPAC name of 4-chloro-5,7-difluoro-3-methyl-2-(4-methyl-2-pyridinyl)quinoline;5,7-difluoro-N-[5-(3-fluoro-4-propan-2-yloxyphenyl)-2-morpholin-4-yl-4-pyridinyl]-3-methyl-2-(4-methyl-2-pyridinyl)quinolin-4-amine;5-(3-fluoro-4-propan-2-yloxyphenyl)-2-morpholin-4-ylpyridin-4-amine?
The IUPAC name of 4-chloro-5,7-difluoro-3-methyl-2-(4-methyl-2-pyridinyl)quinoline;5,7-difluoro-N-[5-(3-fluoro-4-propan-2-yloxyphenyl)-2-morpholin-4-yl-4-pyridinyl]-3-methyl-2-(4-methyl-2-pyridinyl)quinolin-4-amine;5-(3-fluoro-4-propan-2-yloxyphenyl)-2-morpholin-4-ylpyridin-4-amine (CID 159629113) is 4-chloro-5,7-difluoro-3-methyl-2-(4-methyl-2-pyridinyl)quinoline;5,7-difluoro-N-[5-(3-fluoro-4-propan-2-yloxyphenyl)-2-morpholin-4-yl-4-pyridinyl]-3-methyl-2-(4-methyl-2-pyridinyl)quinolin-4-amine;5-(3-fluoro-4-propan-2-yloxyphenyl)-2-morpholin-4-ylpyridin-4-amine.
What is the SMILES notation for 4-chloro-5,7-difluoro-3-methyl-2-(4-methyl-2-pyridinyl)quinoline;5,7-difluoro-N-[5-(3-fluoro-4-propan-2-yloxyphenyl)-2-morpholin-4-yl-4-pyridinyl]-3-methyl-2-(4-methyl-2-pyridinyl)quinolin-4-amine;5-(3-fluoro-4-propan-2-yloxyphenyl)-2-morpholin-4-ylpyridin-4-amine?
The canonical SMILES for 4-chloro-5,7-difluoro-3-methyl-2-(4-methyl-2-pyridinyl)quinoline;5,7-difluoro-N-[5-(3-fluoro-4-propan-2-yloxyphenyl)-2-morpholin-4-yl-4-pyridinyl]-3-methyl-2-(4-methyl-2-pyridinyl)quinolin-4-amine;5-(3-fluoro-4-propan-2-yloxyphenyl)-2-morpholin-4-ylpyridin-4-amine is CC(C)Oc1ccc(-c2cnc(N3CCOCC3)cc2N)cc1F.Cc1ccnc(-c2nc3cc(F)cc(F)c3c(Cl)c2C)c1.Cc1ccnc(-c2nc3cc(F)cc(F)c3c(Nc3cc(N4CCOCC4)ncc3-c3ccc(OC(C)C)c(F)c3)c2C)c1.
What is the InChIKey of 4-chloro-5,7-difluoro-3-methyl-2-(4-methyl-2-pyridinyl)quinoline;5,7-difluoro-N-[5-(3-fluoro-4-propan-2-yloxyphenyl)-2-morpholin-4-yl-4-pyridinyl]-3-methyl-2-(4-methyl-2-pyridinyl)quinolin-4-amine;5-(3-fluoro-4-propan-2-yloxyphenyl)-2-morpholin-4-ylpyridin-4-amine?
The InChIKey is MOWRTIQLSNIGRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H32F3N5O2.C18H22FN3O2.C16H11ClF2N2/c1-19(2)44-30-6-5-22(14-25(30)36)24-18-39-31(42-9-11-43-12-10-42)17-27(24)40-34-21(4)33(29-13-20(3)7-8-38-29)41-28-16-23(35)15-26(37)32(28)34;1-12(2)24-17-4-3-13(9-15(17)19)14-11-21-18(10-16(14)20)22-5-7-23-8-6-22;1-8-3-4-20-13(5-8)16-9(2)15(17)14-11(19)6-10(18)7-12(14)21-16/h5-8,13-19H,9-12H2,1-4H3,(H,39,40,41);3-4,9-12H,5-8H2,1-2H3,(H2,20,21);3-7H,1-2H3.
What are the key properties of 4-chloro-5,7-difluoro-3-methyl-2-(4-methyl-2-pyridinyl)quinoline;5,7-difluoro-N-[5-(3-fluoro-4-propan-2-yloxyphenyl)-2-morpholin-4-yl-4-pyridinyl]-3-methyl-2-(4-methyl-2-pyridinyl)quinolin-4-amine;5-(3-fluoro-4-propan-2-yloxyphenyl)-2-morpholin-4-ylpyridin-4-amine?
4-chloro-5,7-difluoro-3-methyl-2-(4-methyl-2-pyridinyl)quinoline;5,7-difluoro-N-[5-(3-fluoro-4-propan-2-yloxyphenyl)-2-morpholin-4-yl-4-pyridinyl]-3-methyl-2-(4-methyl-2-pyridinyl)quinolin-4-amine;5-(3-fluoro-4-propan-2-yloxyphenyl)-2-morpholin-4-ylpyridin-4-amine has a molecular weight of 1235.77 g/mol, XLogP of 15.70, 12 rotatable bonds, 2 hydrogen bond donors, and 14 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-5,7-difluoro-3-methyl-2-(4-methyl-2-pyridinyl)quinoline;5,7-difluoro-N-[5-(3-fluoro-4-propan-2-yloxyphenyl)-2-morpholin-4-yl-4-pyridinyl]-3-methyl-2-(4-methyl-2-pyridinyl)quinolin-4-amine;5-(3-fluoro-4-propan-2-yloxyphenyl)-2-morpholin-4-ylpyridin-4-amine is sourced from PubChem (CID 159629113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).