2-(5-chloro-2-fluorophenyl)-N-[3-[2-(dimethylamino)ethoxy]-4-pyridinyl]-1,8-naphthyridin-4-amine;[4-[[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]amino]-3-pyridinyl]methanol;4-N-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]pyridine-3,4-diamine;2-[2-fluoro-5-(trifluoromethyl)phenyl]-N-pyrimidin-4-yl-1,8-naphthyridin-4-amine;2-pyridin-2-yl-N-pyridin-4-yl-1,8-naphthyridin-4-amine

C99H72Cl3F7N24O2 — CID 161181644

IUPAC2-(5-chloro-2-fluorophenyl)-N-[3-[2-(dimethylamino)ethoxy]-4-pyridinyl]-1,8-naphthyridin-4-amine;[4-[[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]amino]-3-pyridinyl]methanol;4-N-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]pyridine-3,4-diamine;2-[2-fluoro-5-(trifluoromethyl)phenyl]-N-pyrimidin-4-yl-1,8-naphthyridin-4-amine;2-pyridin-2-yl-N-pyridin-4-yl-1,8-naphthyridin-4-amine
SMILESCN(C)CCOc1cnccc1Nc1cc(-c2cc(Cl)ccc2F)nc2ncccc12.Fc1ccc(C(F)(F)F)cc1-c1cc(Nc2ccncn2)c2cccnc2n1.Nc1cnccc1Nc1cc(-c2cc(Cl)ccc2F)nc2ncccc12.OCc1cnccc1Nc1cc(-c2cc(Cl)ccc2F)nc2ncccc12.c1ccc(-c2cc(Nc3ccncc3)c3cccnc3n2)nc1
InChIInChI=1S/C23H21ClFN5O.C20H14ClFN4O.C19H13ClFN5.C19H11F4N5.C18H13N5/c1-30(2)10-11-31-22-14-26-9-7-19(22)28-20-13-21(17-12-15(24)5-6-18(17)25)29-23-16(20)4-3-8-27-23;21-13-3-4-16(22)15(8-13)19-9-18(14-2-1-6-24-20(14)26-19)25-17-5-7-23-10-12(17)11-27;20-11-3-4-14(21)13(8-11)18-9-17(12-2-1-6-24-19(12)26-18)25-16-5-7-23-10-15(16)22;20-14-4-3-11(19(21,22)23)8-13(14)16-9-15(27-17-5-7-24-10-26-17)12-2-1-6-25-18(12)28-16;1-2-8-20-15(5-1)17-12-16(22-13-6-10-19-11-7-13)14-4-3-9-21-18(14)23-17/h3-9,12-14H,10-11H2,1-2H3,(H,26,27,28,29);1-10,27H,11H2,(H,23,24,25,26);1-10H,22H2,(H,23,24,25,26);1-10H,(H,24,25,26,27,28);1-12H,(H,19,21,22,23)
InChIKeyUSNPTODWLMSHDK-UHFFFAOYSA-N
MW1869.18 g/mol
LogP23.52
Rot. Bonds20

About 2-(5-chloro-2-fluorophenyl)-N-[3-[2-(dimethylamino)ethoxy]-4-pyridinyl]-1,8-naphthyridin-4-amine;[4-[[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]amino]-3-pyridinyl]methanol;4-N-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]pyridine-3,4-diamine;2-[2-fluoro-5-(trifluoromethyl)phenyl]-N-pyrimidin-4-yl-1,8-naphthyridin-4-amine;2-pyridin-2-yl-N-pyridin-4-yl-1,8-naphthyridin-4-amine

2-(5-chloro-2-fluorophenyl)-N-[3-[2-(dimethylamino)ethoxy]-4-pyridinyl]-1,8-naphthyridin-4-amine;[4-[[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]amino]-3-pyridinyl]methanol;4-N-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]pyridine-3,4-diamine;2-[2-fluoro-5-(trifluoromethyl)phenyl]-N-pyrimidin-4-yl-1,8-naphthyridin-4-amine;2-pyridin-2-yl-N-pyridin-4-yl-1,8-naphthyridin-4-amine (PubChem CID 161181644) has the molecular formula C99H72Cl3F7N24O2 and a molecular weight of 1869.18 g/mol. Its IUPAC name is 2-(5-chloro-2-fluorophenyl)-N-[3-[2-(dimethylamino)ethoxy]-4-pyridinyl]-1,8-naphthyridin-4-amine;[4-[[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]amino]-3-pyridinyl]methanol;4-N-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]pyridine-3,4-diamine;2-[2-fluoro-5-(trifluoromethyl)phenyl]-N-pyrimidin-4-yl-1,8-naphthyridin-4-amine;2-pyridin-2-yl-N-pyridin-4-yl-1,8-naphthyridin-4-amine.

Molecular Properties

Compound Name2-(5-chloro-2-fluorophenyl)-N-[3-[2-(dimethylamino)ethoxy]-4-pyridinyl]-1,8-naphthyridin-4-amine;[4-[[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]amino]-3-pyridinyl]methanol;4-N-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]pyridine-3,4-diamine;2-[2-fluoro-5-(trifluoromethyl)phenyl]-N-pyrimidin-4-yl-1,8-naphthyridin-4-amine;2-pyridin-2-yl-N-pyridin-4-yl-1,8-naphthyridin-4-amine
PubChem CID161181644
Molecular FormulaC99H72Cl3F7N24O2
Molecular Weight1869.18 g/mol
Exact Mass1866.52
IUPAC Name2-(5-chloro-2-fluorophenyl)-N-[3-[2-(dimethylamino)ethoxy]-4-pyridinyl]-1,8-naphthyridin-4-amine;[4-[[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]amino]-3-pyridinyl]methanol;4-N-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]pyridine-3,4-diamine;2-[2-fluoro-5-(trifluoromethyl)phenyl]-N-pyrimidin-4-yl-1,8-naphthyridin-4-amine;2-pyridin-2-yl-N-pyridin-4-yl-1,8-naphthyridin-4-amine
SMILESCN(C)CCOc1cnccc1Nc1cc(-c2cc(Cl)ccc2F)nc2ncccc12.Fc1ccc(C(F)(F)F)cc1-c1cc(Nc2ccncn2)c2cccnc2n1.Nc1cnccc1Nc1cc(-c2cc(Cl)ccc2F)nc2ncccc12.OCc1cnccc1Nc1cc(-c2cc(Cl)ccc2F)nc2ncccc12.c1ccc(-c2cc(Nc3ccncc3)c3cccnc3n2)nc1
InChIInChI=1S/C23H21ClFN5O.C20H14ClFN4O.C19H13ClFN5.C19H11F4N5.C18H13N5/c1-30(2)10-11-31-22-14-26-9-7-19(22)28-20-13-21(17-12-15(24)5-6-18(17)25)29-23-16(20)4-3-8-27-23;21-13-3-4-16(22)15(8-13)19-9-18(14-2-1-6-24-20(14)26-19)25-17-5-7-23-10-12(17)11-27;20-11-3-4-14(21)13(8-11)18-9-17(12-2-1-6-24-19(12)26-18)25-16-5-7-23-10-15(16)22;20-14-4-3-11(19(21,22)23)8-13(14)16-9-15(27-17-5-7-24-10-26-17)12-2-1-6-25-18(12)28-16;1-2-8-20-15(5-1)17-12-16(22-13-6-10-19-11-7-13)14-4-3-9-21-18(14)23-17/h3-9,12-14H,10-11H2,1-2H3,(H,26,27,28,29);1-10,27H,11H2,(H,23,24,25,26);1-10H,22H2,(H,23,24,25,26);1-10H,(H,24,25,26,27,28);1-12H,(H,19,21,22,23)
InChIKeyUSNPTODWLMSHDK-UHFFFAOYSA-N
XLogP23.52
TPSA338.00 Ų
H-Bond Donors7
H-Bond Acceptors26
Rotatable Bonds20
Heavy Atoms135
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001869.18
LogP ≤ 523.52
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1026

Analyze 2-(5-chloro-2-fluorophenyl)-N-[3-[2-(dimethylamino)ethoxy]-4-pyridinyl]-1,8-naphthyridin-4-amine;[4-[[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]amino]-3-pyridinyl]methanol;4-N-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]pyridine-3,4-diamine;2-[2-fluoro-5-(trifluoromethyl)phenyl]-N-pyrimidin-4-yl-1,8-naphthyridin-4-amine;2-pyridin-2-yl-N-pyridin-4-yl-1,8-naphthyridin-4-amine with MolForge

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Related Compounds

2-[[4-[[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]amino]-3-pyridinyl]oxy]ethanol;2-(3-chlorophenyl)-N-pyridin-4-yl-1,8-naphthyridin-4-amine;2-(2,5-difluorophenyl)-N-pyridin-4-yl-1,8-naphthyridin-4-amine;2-(2-fluorophenyl)-N-pyridin-4-yl-1,8-naphthyridin-4-amine;N-pyridin-4-yl-2-[3-(trifluoromethyl)phenyl]-1,8-naphthyridin-4-amine
CID 159917775
2-(5-chloro-2-fluorophenyl)-N-pyrimidin-4-yl-1,8-naphthyridin-4-amine
CID 53373517
2-[5-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]isoquinolin-8-yl]oxy-N,N-dimethylethanamine
CID 56592560
methyl 4-[[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]amino]pyridine-3-carboxylate
CID 53372324
[4-[[2-(5-chloro-2-fluorophenyl)-5-propan-2-yl-4-pyridinyl]amino]-3-pyridinyl]methanol
CID 118211486
N-[4-[[2-(5-chloro-2-fluorophenyl)quinolin-4-yl]amino]-3-pyridinyl]-3-(dimethylamino)propanamide
CID 70660142
potassium;4-chloro-2-(5-chloro-2-fluorophenyl)-1,8-naphthyridine;2-(5-chloro-2-fluorophenyl)-N-[3-(3-morpholin-4-ylpropoxy)-4-pyridinyl]-1,8-naphthyridin-4-amine;3-fluoro-4-nitro-1-oxidopyridin-1-ium;methane;2-methylpropan-2-olate;molecular hydrogen;3-morpholin-4-ylpropan-1-ol;3-(3-morpholin-4-ylpropoxy)pyridin-4-amine;4-[3-(4-nitro-1-oxidopyridin-1-ium-3-yl)oxypropyl]morpholine
CID 159891355
N-[5-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]isoquinolin-8-yl]-N',N'-diethylethane-1,2-diamine
CID 56592654
N-[6-[[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]amino]pyrimidin-4-yl]-1-methylpiperidine-4-carboxamide
CID 53372592
4-N-[2-(6-fluoro-4-methylcyclohexa-1,5-dien-1-yl)-1,8-naphthyridin-4-yl]pyridine-3,4-diamine
CID 123823768
[[4-[[2-(5-chloro-2-fluorophenyl)quinolin-4-yl]-methylamino]-3-pyridinyl]amino]methanol
CID 70661362
N-[4-[2-fluoro-5-(trifluoromethyl)phenyl]-5-methyl-1,3-thiazol-2-yl]-4-(pyrimidin-4-ylamino)benzamide
CID 87739956

Frequently Asked Questions

What is the IUPAC name of 2-(5-chloro-2-fluorophenyl)-N-[3-[2-(dimethylamino)ethoxy]-4-pyridinyl]-1,8-naphthyridin-4-amine;[4-[[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]amino]-3-pyridinyl]methanol;4-N-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]pyridine-3,4-diamine;2-[2-fluoro-5-(trifluoromethyl)phenyl]-N-pyrimidin-4-yl-1,8-naphthyridin-4-amine;2-pyridin-2-yl-N-pyridin-4-yl-1,8-naphthyridin-4-amine?
The IUPAC name of 2-(5-chloro-2-fluorophenyl)-N-[3-[2-(dimethylamino)ethoxy]-4-pyridinyl]-1,8-naphthyridin-4-amine;[4-[[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]amino]-3-pyridinyl]methanol;4-N-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]pyridine-3,4-diamine;2-[2-fluoro-5-(trifluoromethyl)phenyl]-N-pyrimidin-4-yl-1,8-naphthyridin-4-amine;2-pyridin-2-yl-N-pyridin-4-yl-1,8-naphthyridin-4-amine (CID 161181644) is 2-(5-chloro-2-fluorophenyl)-N-[3-[2-(dimethylamino)ethoxy]-4-pyridinyl]-1,8-naphthyridin-4-amine;[4-[[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]amino]-3-pyridinyl]methanol;4-N-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]pyridine-3,4-diamine;2-[2-fluoro-5-(trifluoromethyl)phenyl]-N-pyrimidin-4-yl-1,8-naphthyridin-4-amine;2-pyridin-2-yl-N-pyridin-4-yl-1,8-naphthyridin-4-amine.
What is the SMILES notation for 2-(5-chloro-2-fluorophenyl)-N-[3-[2-(dimethylamino)ethoxy]-4-pyridinyl]-1,8-naphthyridin-4-amine;[4-[[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]amino]-3-pyridinyl]methanol;4-N-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]pyridine-3,4-diamine;2-[2-fluoro-5-(trifluoromethyl)phenyl]-N-pyrimidin-4-yl-1,8-naphthyridin-4-amine;2-pyridin-2-yl-N-pyridin-4-yl-1,8-naphthyridin-4-amine?
The canonical SMILES for 2-(5-chloro-2-fluorophenyl)-N-[3-[2-(dimethylamino)ethoxy]-4-pyridinyl]-1,8-naphthyridin-4-amine;[4-[[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]amino]-3-pyridinyl]methanol;4-N-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]pyridine-3,4-diamine;2-[2-fluoro-5-(trifluoromethyl)phenyl]-N-pyrimidin-4-yl-1,8-naphthyridin-4-amine;2-pyridin-2-yl-N-pyridin-4-yl-1,8-naphthyridin-4-amine is CN(C)CCOc1cnccc1Nc1cc(-c2cc(Cl)ccc2F)nc2ncccc12.Fc1ccc(C(F)(F)F)cc1-c1cc(Nc2ccncn2)c2cccnc2n1.Nc1cnccc1Nc1cc(-c2cc(Cl)ccc2F)nc2ncccc12.OCc1cnccc1Nc1cc(-c2cc(Cl)ccc2F)nc2ncccc12.c1ccc(-c2cc(Nc3ccncc3)c3cccnc3n2)nc1.
What is the InChIKey of 2-(5-chloro-2-fluorophenyl)-N-[3-[2-(dimethylamino)ethoxy]-4-pyridinyl]-1,8-naphthyridin-4-amine;[4-[[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]amino]-3-pyridinyl]methanol;4-N-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]pyridine-3,4-diamine;2-[2-fluoro-5-(trifluoromethyl)phenyl]-N-pyrimidin-4-yl-1,8-naphthyridin-4-amine;2-pyridin-2-yl-N-pyridin-4-yl-1,8-naphthyridin-4-amine?
The InChIKey is USNPTODWLMSHDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H21ClFN5O.C20H14ClFN4O.C19H13ClFN5.C19H11F4N5.C18H13N5/c1-30(2)10-11-31-22-14-26-9-7-19(22)28-20-13-21(17-12-15(24)5-6-18(17)25)29-23-16(20)4-3-8-27-23;21-13-3-4-16(22)15(8-13)19-9-18(14-2-1-6-24-20(14)26-19)25-17-5-7-23-10-12(17)11-27;20-11-3-4-14(21)13(8-11)18-9-17(12-2-1-6-24-19(12)26-18)25-16-5-7-23-10-15(16)22;20-14-4-3-11(19(21,22)23)8-13(14)16-9-15(27-17-5-7-24-10-26-17)12-2-1-6-25-18(12)28-16;1-2-8-20-15(5-1)17-12-16(22-13-6-10-19-11-7-13)14-4-3-9-21-18(14)23-17/h3-9,12-14H,10-11H2,1-2H3,(H,26,27,28,29);1-10,27H,11H2,(H,23,24,25,26);1-10H,22H2,(H,23,24,25,26);1-10H,(H,24,25,26,27,28);1-12H,(H,19,21,22,23).
What are the key properties of 2-(5-chloro-2-fluorophenyl)-N-[3-[2-(dimethylamino)ethoxy]-4-pyridinyl]-1,8-naphthyridin-4-amine;[4-[[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]amino]-3-pyridinyl]methanol;4-N-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]pyridine-3,4-diamine;2-[2-fluoro-5-(trifluoromethyl)phenyl]-N-pyrimidin-4-yl-1,8-naphthyridin-4-amine;2-pyridin-2-yl-N-pyridin-4-yl-1,8-naphthyridin-4-amine?
2-(5-chloro-2-fluorophenyl)-N-[3-[2-(dimethylamino)ethoxy]-4-pyridinyl]-1,8-naphthyridin-4-amine;[4-[[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]amino]-3-pyridinyl]methanol;4-N-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]pyridine-3,4-diamine;2-[2-fluoro-5-(trifluoromethyl)phenyl]-N-pyrimidin-4-yl-1,8-naphthyridin-4-amine;2-pyridin-2-yl-N-pyridin-4-yl-1,8-naphthyridin-4-amine has a molecular weight of 1869.18 g/mol, XLogP of 23.52, 20 rotatable bonds, 7 hydrogen bond donors, and 26 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-chloro-2-fluorophenyl)-N-[3-[2-(dimethylamino)ethoxy]-4-pyridinyl]-1,8-naphthyridin-4-amine;[4-[[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]amino]-3-pyridinyl]methanol;4-N-[2-(5-chloro-2-fluorophenyl)-1,8-naphthyridin-4-yl]pyridine-3,4-diamine;2-[2-fluoro-5-(trifluoromethyl)phenyl]-N-pyrimidin-4-yl-1,8-naphthyridin-4-amine;2-pyridin-2-yl-N-pyridin-4-yl-1,8-naphthyridin-4-amine is sourced from PubChem (CID 161181644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).