N-[5-(5-acetyl-2-fluorophenyl)-6-amino-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(2-chloro-5-methoxy-4-pyridinyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(2-chloro-5-methylphenyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-[2-chloro-5-(trifluoromethyl)phenyl]-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-[2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-2-pyridinyl]-4-methylbenzamide

C101H84Cl3F7N18O7 — CID 161315535

IUPACN-[5-(5-acetyl-2-fluorophenyl)-6-amino-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(2-chloro-5-methoxy-4-pyridinyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(2-chloro-5-methylphenyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-[2-chloro-5-(trifluoromethyl)phenyl]-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-[2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-2-pyridinyl]-4-methylbenzamide
SMILESCC(=O)c1ccc(F)c(-c2ccc(NC(=O)c3ccc(C)cc3)nc2N)c1.COc1cnc(Cl)cc1-c1ccc(NC(=O)c2ccc(C)cc2)nc1N.Cc1ccc(C(=O)Nc2ccc(-c3c(C(F)(F)F)nc4ccccn34)c(N)n2)cc1.Cc1ccc(C(=O)Nc2ccc(-c3cc(C(F)(F)F)ccc3Cl)c(N)n2)cc1.Cc1ccc(C(=O)Nc2ccc(-c3cc(C)ccc3Cl)c(N)n2)cc1
InChIInChI=1S/C21H16F3N5O.C21H18FN3O2.C20H15ClF3N3O.C20H18ClN3O.C19H17ClN4O2/c1-12-5-7-13(8-6-12)20(30)27-15-10-9-14(19(25)26-15)17-18(21(22,23)24)28-16-4-2-3-11-29(16)17;1-12-3-5-14(6-4-12)21(27)25-19-10-8-16(20(23)24-19)17-11-15(13(2)26)7-9-18(17)22;1-11-2-4-12(5-3-11)19(28)27-17-9-7-14(18(25)26-17)15-10-13(20(22,23)24)6-8-16(15)21;1-12-3-6-14(7-4-12)20(25)24-18-10-8-15(19(22)23-18)16-11-13(2)5-9-17(16)21;1-11-3-5-12(6-4-11)19(25)24-17-8-7-13(18(21)23-17)14-9-16(20)22-10-15(14)26-2/h2-11H,1H3,(H3,25,26,27,30);3-11H,1-2H3,(H3,23,24,25,27);2-10H,1H3,(H3,25,26,27,28);3-11H,1-2H3,(H3,22,23,24,25);3-10H,1-2H3,(H3,21,23,24,25)
InChIKeyVJLFUABRNXHALQ-UHFFFAOYSA-N
MW1901.25 g/mol
LogP23.16
Rot. Bonds17

About N-[5-(5-acetyl-2-fluorophenyl)-6-amino-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(2-chloro-5-methoxy-4-pyridinyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(2-chloro-5-methylphenyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-[2-chloro-5-(trifluoromethyl)phenyl]-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-[2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-2-pyridinyl]-4-methylbenzamide

N-[5-(5-acetyl-2-fluorophenyl)-6-amino-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(2-chloro-5-methoxy-4-pyridinyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(2-chloro-5-methylphenyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-[2-chloro-5-(trifluoromethyl)phenyl]-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-[2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-2-pyridinyl]-4-methylbenzamide (PubChem CID 161315535) has the molecular formula C101H84Cl3F7N18O7 and a molecular weight of 1901.25 g/mol. Its IUPAC name is N-[5-(5-acetyl-2-fluorophenyl)-6-amino-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(2-chloro-5-methoxy-4-pyridinyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(2-chloro-5-methylphenyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-[2-chloro-5-(trifluoromethyl)phenyl]-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-[2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-2-pyridinyl]-4-methylbenzamide.

Molecular Properties

Compound NameN-[5-(5-acetyl-2-fluorophenyl)-6-amino-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(2-chloro-5-methoxy-4-pyridinyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(2-chloro-5-methylphenyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-[2-chloro-5-(trifluoromethyl)phenyl]-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-[2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-2-pyridinyl]-4-methylbenzamide
PubChem CID161315535
Molecular FormulaC101H84Cl3F7N18O7
Molecular Weight1901.25 g/mol
Exact Mass1898.57
IUPAC NameN-[5-(5-acetyl-2-fluorophenyl)-6-amino-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(2-chloro-5-methoxy-4-pyridinyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(2-chloro-5-methylphenyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-[2-chloro-5-(trifluoromethyl)phenyl]-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-[2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-2-pyridinyl]-4-methylbenzamide
SMILESCC(=O)c1ccc(F)c(-c2ccc(NC(=O)c3ccc(C)cc3)nc2N)c1.COc1cnc(Cl)cc1-c1ccc(NC(=O)c2ccc(C)cc2)nc1N.Cc1ccc(C(=O)Nc2ccc(-c3c(C(F)(F)F)nc4ccccn34)c(N)n2)cc1.Cc1ccc(C(=O)Nc2ccc(-c3cc(C(F)(F)F)ccc3Cl)c(N)n2)cc1.Cc1ccc(C(=O)Nc2ccc(-c3cc(C)ccc3Cl)c(N)n2)cc1
InChIInChI=1S/C21H16F3N5O.C21H18FN3O2.C20H15ClF3N3O.C20H18ClN3O.C19H17ClN4O2/c1-12-5-7-13(8-6-12)20(30)27-15-10-9-14(19(25)26-15)17-18(21(22,23)24)28-16-4-2-3-11-29(16)17;1-12-3-5-14(6-4-12)21(27)25-19-10-8-16(20(23)24-19)17-11-15(13(2)26)7-9-18(17)22;1-11-2-4-12(5-3-11)19(28)27-17-9-7-14(18(25)26-17)15-10-13(20(22,23)24)6-8-16(15)21;1-12-3-6-14(7-4-12)20(25)24-18-10-8-15(19(22)23-18)16-11-13(2)5-9-17(16)21;1-11-3-5-12(6-4-11)19(25)24-17-8-7-13(18(21)23-17)14-9-16(20)22-10-15(14)26-2/h2-11H,1H3,(H3,25,26,27,30);3-11H,1-2H3,(H3,23,24,25,27);2-10H,1H3,(H3,25,26,27,28);3-11H,1-2H3,(H3,22,23,24,25);3-10H,1-2H3,(H3,21,23,24,25)
InChIKeyVJLFUABRNXHALQ-UHFFFAOYSA-N
XLogP23.16
TPSA396.54 Ų
H-Bond Donors10
H-Bond Acceptors20
Rotatable Bonds17
Heavy Atoms136
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001901.25
LogP ≤ 523.16
H-Bond Donors ≤ 510
H-Bond Acceptors ≤ 1020

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Analyze N-[5-(5-acetyl-2-fluorophenyl)-6-amino-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(2-chloro-5-methoxy-4-pyridinyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(2-chloro-5-methylphenyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-[2-chloro-5-(trifluoromethyl)phenyl]-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-[2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-2-pyridinyl]-4-methylbenzamide with MolForge

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Related Compounds

N-(4-chloro-2-fluorophenyl)-3-[3-[2-[2-methoxy-4-(4-piperidin-1-ylpiperidin-1-yl)anilino]pyrimidin-4-yl]imidazo[1,2-a]pyridin-2-yl]benzamide
CID 59860265
4-chloro-N-[3-[8-[[3-(trifluoromethoxy)benzoyl]amino]imidazo[1,2-a]pyrazin-3-yl]phenyl]-3-(trifluoromethyl)benzamide
CID 127042947
1-[4-[[6-[2-Chloro-3-[3-chloro-2-[2-[(3,3-difluoropyrrolidin-1-yl)methyl]-8-methoxyimidazo[1,2-a]pyridin-6-yl]-4-pyridinyl]phenyl]-2-methoxy-3-pyridinyl]methylamino]piperidin-1-yl]ethanone
CID 170696941
1-[4-[[6-[2-Chloro-3-[3-chloro-2-[2-[(2,2-difluoroethylamino)methyl]-8-methoxyimidazo[1,2-a]pyridin-6-yl]-4-pyridinyl]phenyl]-2-methoxy-3-pyridinyl]methylamino]piperidin-1-yl]ethanone
CID 170697153
4-chloro-N-[3-fluoro-4-(3-imidazol-1-ylquinoxalin-6-yl)oxyphenyl]-3-(trifluoromethyl)benzamide;4-chloro-N-[3-fluoro-4-(3-pyridin-3-ylquinoxalin-6-yl)oxyphenyl]-3-(trifluoromethyl)benzamide;N-[2,3-difluoro-4-[3-(6-methyl-3-pyridinyl)quinoxalin-6-yl]oxyphenyl]-3-fluorobenzamide
CID 89719630
N-[4-chloro-3-(trifluoromethyl)phenyl]-3-[[1-[[4-[[2-methoxy-5-(trifluoromethyl)phenyl]carbamoyl]-2-[[6-(4-methylpiperazin-1-yl)-1-[[2-[[6-(4-methylpiperazin-1-yl)pyrimido[5,4-d]pyrimidin-4-yl]amino]-4-[[3-(trifluoromethyl)phenyl]carbamoyl]phenyl]methyl]pyrimido[5,4-d]pyrimidin-1-ium-4-yl]amino]phenyl]methyl]-6-(4-methylpiperazin-1-yl)pyrimido[5,4-d]pyrimidin-1-ium-4-yl]amino]-4-methylbenzamide
CID 90985611
4-[(4-ethylpiperazin-1-yl)methyl]-N-[4-[2-(6-methoxyimidazo[1,2-a]pyridin-3-yl)ethynyl]pyridin-2-yl]-3-(trifluoromethyl)benzamide
CID 123391823
2-chloro-N-[3-[(4-methylpiperazin-1-yl)methyl]-5-(trifluoromethyl)phenyl]-5-(9-propan-2-yl-2-pyridin-4-ylpurin-6-yl)oxybenzamide
CID 146555688
4-[6-(3-Chlorophenoxy)-8-(3,3,3-trifluoropropylamino)imidazo[1,2-a]pyridin-3-yl]-2-methylbenzoic acid;methyl 4-[6-(3-chlorophenoxy)-8-(3,3,3-trifluoropropylamino)imidazo[1,2-a]pyridin-3-yl]-2-methylbenzoate
CID 157455402
2-[2-(4-Chlorophenyl)-3-[[4-(3-fluorobenzoyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridin-6-yl]benzonitrile;4-[[2-(4-chlorophenyl)-6-methoxyimidazo[1,2-a]pyridin-3-yl]methyl]morpholine;[4-[[2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-pyridin-4-ylmethanone;4-[[2-(4-chlorophenyl)-6-[2-(trifluoromethoxy)phenyl]imidazo[1,2-a]pyridin-3-yl]methyl]morpholine
CID 157665550
N-(6-chloro-3-pyridinyl)-4-[(E)-pent-1-enyl]benzamide;4-[(E)-4,4-dimethylpent-2-en-2-yl]-N-(4-methyl-2-pyridinyl)benzamide;4-[(E)-4,4-dimethylpent-2-en-2-yl]-N-pyrimidin-4-ylbenzamide;4-[(E)-4,4-dimethylpent-2-en-2-yl]-N-[5-(trifluoromethyl)-2-pyridinyl]benzamide;N-(6-methoxy-3-pyridinyl)-4-[(E)-pent-1-enyl]benzamide;N-(2-methyl-4-pyridinyl)-4-[(E)-pent-1-enyl]benzamide
CID 157733649
4-chloro-1-fluoro-2-propan-2-ylbenzene;3-chloro-4-propan-2-ylpyridin-2-amine;2-chloro-3-propan-2-ylpyridine;3-chloro-4-propan-2-ylpyridine;1-methoxy-4-propan-2-ylbenzene;N-methyl-2-propan-2-ylbenzamide;1-methyl-2-propan-2-ylimidazole;3-propan-2-ylbenzamide;3-propan-2-yl-2-(trifluoromethyl)pyridine
CID 157905763

Frequently Asked Questions

What is the IUPAC name of N-[5-(5-acetyl-2-fluorophenyl)-6-amino-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(2-chloro-5-methoxy-4-pyridinyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(2-chloro-5-methylphenyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-[2-chloro-5-(trifluoromethyl)phenyl]-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-[2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-2-pyridinyl]-4-methylbenzamide?
The IUPAC name of N-[5-(5-acetyl-2-fluorophenyl)-6-amino-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(2-chloro-5-methoxy-4-pyridinyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(2-chloro-5-methylphenyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-[2-chloro-5-(trifluoromethyl)phenyl]-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-[2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-2-pyridinyl]-4-methylbenzamide (CID 161315535) is N-[5-(5-acetyl-2-fluorophenyl)-6-amino-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(2-chloro-5-methoxy-4-pyridinyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(2-chloro-5-methylphenyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-[2-chloro-5-(trifluoromethyl)phenyl]-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-[2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-2-pyridinyl]-4-methylbenzamide.
What is the SMILES notation for N-[5-(5-acetyl-2-fluorophenyl)-6-amino-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(2-chloro-5-methoxy-4-pyridinyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(2-chloro-5-methylphenyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-[2-chloro-5-(trifluoromethyl)phenyl]-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-[2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-2-pyridinyl]-4-methylbenzamide?
The canonical SMILES for N-[5-(5-acetyl-2-fluorophenyl)-6-amino-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(2-chloro-5-methoxy-4-pyridinyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(2-chloro-5-methylphenyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-[2-chloro-5-(trifluoromethyl)phenyl]-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-[2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-2-pyridinyl]-4-methylbenzamide is CC(=O)c1ccc(F)c(-c2ccc(NC(=O)c3ccc(C)cc3)nc2N)c1.COc1cnc(Cl)cc1-c1ccc(NC(=O)c2ccc(C)cc2)nc1N.Cc1ccc(C(=O)Nc2ccc(-c3c(C(F)(F)F)nc4ccccn34)c(N)n2)cc1.Cc1ccc(C(=O)Nc2ccc(-c3cc(C(F)(F)F)ccc3Cl)c(N)n2)cc1.Cc1ccc(C(=O)Nc2ccc(-c3cc(C)ccc3Cl)c(N)n2)cc1.
What is the InChIKey of N-[5-(5-acetyl-2-fluorophenyl)-6-amino-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(2-chloro-5-methoxy-4-pyridinyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(2-chloro-5-methylphenyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-[2-chloro-5-(trifluoromethyl)phenyl]-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-[2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-2-pyridinyl]-4-methylbenzamide?
The InChIKey is VJLFUABRNXHALQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H16F3N5O.C21H18FN3O2.C20H15ClF3N3O.C20H18ClN3O.C19H17ClN4O2/c1-12-5-7-13(8-6-12)20(30)27-15-10-9-14(19(25)26-15)17-18(21(22,23)24)28-16-4-2-3-11-29(16)17;1-12-3-5-14(6-4-12)21(27)25-19-10-8-16(20(23)24-19)17-11-15(13(2)26)7-9-18(17)22;1-11-2-4-12(5-3-11)19(28)27-17-9-7-14(18(25)26-17)15-10-13(20(22,23)24)6-8-16(15)21;1-12-3-6-14(7-4-12)20(25)24-18-10-8-15(19(22)23-18)16-11-13(2)5-9-17(16)21;1-11-3-5-12(6-4-11)19(25)24-17-8-7-13(18(21)23-17)14-9-16(20)22-10-15(14)26-2/h2-11H,1H3,(H3,25,26,27,30);3-11H,1-2H3,(H3,23,24,25,27);2-10H,1H3,(H3,25,26,27,28);3-11H,1-2H3,(H3,22,23,24,25);3-10H,1-2H3,(H3,21,23,24,25).
What are the key properties of N-[5-(5-acetyl-2-fluorophenyl)-6-amino-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(2-chloro-5-methoxy-4-pyridinyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(2-chloro-5-methylphenyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-[2-chloro-5-(trifluoromethyl)phenyl]-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-[2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-2-pyridinyl]-4-methylbenzamide?
N-[5-(5-acetyl-2-fluorophenyl)-6-amino-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(2-chloro-5-methoxy-4-pyridinyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(2-chloro-5-methylphenyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-[2-chloro-5-(trifluoromethyl)phenyl]-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-[2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-2-pyridinyl]-4-methylbenzamide has a molecular weight of 1901.25 g/mol, XLogP of 23.16, 17 rotatable bonds, 10 hydrogen bond donors, and 20 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(5-acetyl-2-fluorophenyl)-6-amino-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(2-chloro-5-methoxy-4-pyridinyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(2-chloro-5-methylphenyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-[2-chloro-5-(trifluoromethyl)phenyl]-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-[2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-2-pyridinyl]-4-methylbenzamide is sourced from PubChem (CID 161315535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).