N-[6-amino-5-[2,5-bis(trifluoromethyl)phenyl]-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(3-bromo-2-methoxy-5-methylphenyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(6-chloro-2-fluoro-3-methylphenyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(3-methoxynaphthalen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-[2-methoxy-5-(trifluoromethoxy)phenyl]-2-pyridinyl]-4-methylbenzamide;methyl 3-[2-amino-6-[(4-methylbenzoyl)amino]-3-pyridinyl]-4-chlorobenzoate

C128H109BrCl2F10N18O12 — CID 159928863

IUPACN-[6-amino-5-[2,5-bis(trifluoromethyl)phenyl]-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(3-bromo-2-methoxy-5-methylphenyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(6-chloro-2-fluoro-3-methylphenyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(3-methoxynaphthalen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-[2-methoxy-5-(trifluoromethoxy)phenyl]-2-pyridinyl]-4-methylbenzamide;methyl 3-[2-amino-6-[(4-methylbenzoyl)amino]-3-pyridinyl]-4-chlorobenzoate
SMILESCOC(=O)c1ccc(Cl)c(-c2ccc(NC(=O)c3ccc(C)cc3)nc2N)c1.COc1c(Br)cc(C)cc1-c1ccc(NC(=O)c2ccc(C)cc2)nc1N.COc1cc2ccccc2cc1-c1ccc(NC(=O)c2ccc(C)cc2)nc1N.COc1ccc(OC(F)(F)F)cc1-c1ccc(NC(=O)c2ccc(C)cc2)nc1N.Cc1ccc(C(=O)Nc2ccc(-c3c(Cl)ccc(C)c3F)c(N)n2)cc1.Cc1ccc(C(=O)Nc2ccc(-c3cc(C(F)(F)F)ccc3C(F)(F)F)c(N)n2)cc1
InChIInChI=1S/C24H21N3O2.C21H20BrN3O2.C21H18ClN3O3.C21H15F6N3O.C21H18F3N3O3.C20H17ClFN3O/c1-15-7-9-16(10-8-15)24(28)27-22-12-11-19(23(25)26-22)20-13-17-5-3-4-6-18(17)14-21(20)29-2;1-12-4-6-14(7-5-12)21(26)25-18-9-8-15(20(23)24-18)16-10-13(2)11-17(22)19(16)27-3;1-12-3-5-13(6-4-12)20(26)25-18-10-8-15(19(23)24-18)16-11-14(21(27)28-2)7-9-17(16)22;1-11-2-4-12(5-3-11)19(31)30-17-9-7-14(18(28)29-17)15-10-13(20(22,23)24)6-8-16(15)21(25,26)27;1-12-3-5-13(6-4-12)20(28)27-18-10-8-15(19(25)26-18)16-11-14(30-21(22,23)24)7-9-17(16)29-2;1-11-3-6-13(7-4-11)20(26)25-16-10-8-14(19(23)24-16)17-15(21)9-5-12(2)18(17)22/h3-14H,1-2H3,(H3,25,26,27,28);4-11H,1-3H3,(H3,23,24,25,26);3-11H,1-2H3,(H3,23,24,25,26);2-10H,1H3,(H3,28,29,30,31);3-11H,1-2H3,(H3,25,26,27,28);3-10H,1-2H3,(H3,23,24,25,26)
InChIKeyNZJJEPMJLUBNNO-UHFFFAOYSA-N
MW2432.18 g/mol
LogP30.08
Rot. Bonds23

About N-[6-amino-5-[2,5-bis(trifluoromethyl)phenyl]-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(3-bromo-2-methoxy-5-methylphenyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(6-chloro-2-fluoro-3-methylphenyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(3-methoxynaphthalen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-[2-methoxy-5-(trifluoromethoxy)phenyl]-2-pyridinyl]-4-methylbenzamide;methyl 3-[2-amino-6-[(4-methylbenzoyl)amino]-3-pyridinyl]-4-chlorobenzoate

N-[6-amino-5-[2,5-bis(trifluoromethyl)phenyl]-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(3-bromo-2-methoxy-5-methylphenyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(6-chloro-2-fluoro-3-methylphenyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(3-methoxynaphthalen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-[2-methoxy-5-(trifluoromethoxy)phenyl]-2-pyridinyl]-4-methylbenzamide;methyl 3-[2-amino-6-[(4-methylbenzoyl)amino]-3-pyridinyl]-4-chlorobenzoate (PubChem CID 159928863) has the molecular formula C128H109BrCl2F10N18O12 and a molecular weight of 2432.18 g/mol. Its IUPAC name is N-[6-amino-5-[2,5-bis(trifluoromethyl)phenyl]-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(3-bromo-2-methoxy-5-methylphenyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(6-chloro-2-fluoro-3-methylphenyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(3-methoxynaphthalen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-[2-methoxy-5-(trifluoromethoxy)phenyl]-2-pyridinyl]-4-methylbenzamide;methyl 3-[2-amino-6-[(4-methylbenzoyl)amino]-3-pyridinyl]-4-chlorobenzoate.

Molecular Properties

Compound NameN-[6-amino-5-[2,5-bis(trifluoromethyl)phenyl]-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(3-bromo-2-methoxy-5-methylphenyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(6-chloro-2-fluoro-3-methylphenyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(3-methoxynaphthalen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-[2-methoxy-5-(trifluoromethoxy)phenyl]-2-pyridinyl]-4-methylbenzamide;methyl 3-[2-amino-6-[(4-methylbenzoyl)amino]-3-pyridinyl]-4-chlorobenzoate
PubChem CID159928863
Molecular FormulaC128H109BrCl2F10N18O12
Molecular Weight2432.18 g/mol
Exact Mass2428.69
IUPAC NameN-[6-amino-5-[2,5-bis(trifluoromethyl)phenyl]-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(3-bromo-2-methoxy-5-methylphenyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(6-chloro-2-fluoro-3-methylphenyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(3-methoxynaphthalen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-[2-methoxy-5-(trifluoromethoxy)phenyl]-2-pyridinyl]-4-methylbenzamide;methyl 3-[2-amino-6-[(4-methylbenzoyl)amino]-3-pyridinyl]-4-chlorobenzoate
SMILESCOC(=O)c1ccc(Cl)c(-c2ccc(NC(=O)c3ccc(C)cc3)nc2N)c1.COc1c(Br)cc(C)cc1-c1ccc(NC(=O)c2ccc(C)cc2)nc1N.COc1cc2ccccc2cc1-c1ccc(NC(=O)c2ccc(C)cc2)nc1N.COc1ccc(OC(F)(F)F)cc1-c1ccc(NC(=O)c2ccc(C)cc2)nc1N.Cc1ccc(C(=O)Nc2ccc(-c3c(Cl)ccc(C)c3F)c(N)n2)cc1.Cc1ccc(C(=O)Nc2ccc(-c3cc(C(F)(F)F)ccc3C(F)(F)F)c(N)n2)cc1
InChIInChI=1S/C24H21N3O2.C21H20BrN3O2.C21H18ClN3O3.C21H15F6N3O.C21H18F3N3O3.C20H17ClFN3O/c1-15-7-9-16(10-8-15)24(28)27-22-12-11-19(23(25)26-22)20-13-17-5-3-4-6-18(17)14-21(20)29-2;1-12-4-6-14(7-5-12)21(26)25-18-9-8-15(20(23)24-18)16-10-13(2)11-17(22)19(16)27-3;1-12-3-5-13(6-4-12)20(26)25-18-10-8-15(19(23)24-18)16-11-14(21(27)28-2)7-9-17(16)22;1-11-2-4-12(5-3-11)19(31)30-17-9-7-14(18(28)29-17)15-10-13(20(22,23)24)6-8-16(15)21(25,26)27;1-12-3-5-13(6-4-12)20(28)27-18-10-8-15(19(25)26-18)16-11-14(30-21(22,23)24)7-9-17(16)29-2;1-11-3-6-13(7-4-11)20(26)25-16-10-8-14(19(23)24-16)17-15(21)9-5-12(2)18(17)22/h3-14H,1-2H3,(H3,25,26,27,28);4-11H,1-3H3,(H3,23,24,25,26);3-11H,1-2H3,(H3,23,24,25,26);2-10H,1H3,(H3,28,29,30,31);3-11H,1-2H3,(H3,25,26,27,28);3-10H,1-2H3,(H3,23,24,25,26)
InChIKeyNZJJEPMJLUBNNO-UHFFFAOYSA-N
XLogP30.08
TPSA471.28 Ų
H-Bond Donors12
H-Bond Acceptors24
Rotatable Bonds23
Heavy Atoms171
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002432.18
LogP ≤ 530.08
H-Bond Donors ≤ 512
H-Bond Acceptors ≤ 1024

Analyze N-[6-amino-5-[2,5-bis(trifluoromethyl)phenyl]-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(3-bromo-2-methoxy-5-methylphenyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(6-chloro-2-fluoro-3-methylphenyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(3-methoxynaphthalen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-[2-methoxy-5-(trifluoromethoxy)phenyl]-2-pyridinyl]-4-methylbenzamide;methyl 3-[2-amino-6-[(4-methylbenzoyl)amino]-3-pyridinyl]-4-chlorobenzoate with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-[6-amino-5-[2,5-bis(trifluoromethyl)phenyl]-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(3-bromo-2-methoxy-5-methylphenyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(6-chloro-2-fluoro-3-methylphenyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(3-methoxynaphthalen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-[2-methoxy-5-(trifluoromethoxy)phenyl]-2-pyridinyl]-4-methylbenzamide;methyl 3-[2-amino-6-[(4-methylbenzoyl)amino]-3-pyridinyl]-4-chlorobenzoate?
The IUPAC name of N-[6-amino-5-[2,5-bis(trifluoromethyl)phenyl]-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(3-bromo-2-methoxy-5-methylphenyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(6-chloro-2-fluoro-3-methylphenyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(3-methoxynaphthalen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-[2-methoxy-5-(trifluoromethoxy)phenyl]-2-pyridinyl]-4-methylbenzamide;methyl 3-[2-amino-6-[(4-methylbenzoyl)amino]-3-pyridinyl]-4-chlorobenzoate (CID 159928863) is N-[6-amino-5-[2,5-bis(trifluoromethyl)phenyl]-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(3-bromo-2-methoxy-5-methylphenyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(6-chloro-2-fluoro-3-methylphenyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(3-methoxynaphthalen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-[2-methoxy-5-(trifluoromethoxy)phenyl]-2-pyridinyl]-4-methylbenzamide;methyl 3-[2-amino-6-[(4-methylbenzoyl)amino]-3-pyridinyl]-4-chlorobenzoate.
What is the SMILES notation for N-[6-amino-5-[2,5-bis(trifluoromethyl)phenyl]-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(3-bromo-2-methoxy-5-methylphenyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(6-chloro-2-fluoro-3-methylphenyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(3-methoxynaphthalen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-[2-methoxy-5-(trifluoromethoxy)phenyl]-2-pyridinyl]-4-methylbenzamide;methyl 3-[2-amino-6-[(4-methylbenzoyl)amino]-3-pyridinyl]-4-chlorobenzoate?
The canonical SMILES for N-[6-amino-5-[2,5-bis(trifluoromethyl)phenyl]-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(3-bromo-2-methoxy-5-methylphenyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(6-chloro-2-fluoro-3-methylphenyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(3-methoxynaphthalen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-[2-methoxy-5-(trifluoromethoxy)phenyl]-2-pyridinyl]-4-methylbenzamide;methyl 3-[2-amino-6-[(4-methylbenzoyl)amino]-3-pyridinyl]-4-chlorobenzoate is COC(=O)c1ccc(Cl)c(-c2ccc(NC(=O)c3ccc(C)cc3)nc2N)c1.COc1c(Br)cc(C)cc1-c1ccc(NC(=O)c2ccc(C)cc2)nc1N.COc1cc2ccccc2cc1-c1ccc(NC(=O)c2ccc(C)cc2)nc1N.COc1ccc(OC(F)(F)F)cc1-c1ccc(NC(=O)c2ccc(C)cc2)nc1N.Cc1ccc(C(=O)Nc2ccc(-c3c(Cl)ccc(C)c3F)c(N)n2)cc1.Cc1ccc(C(=O)Nc2ccc(-c3cc(C(F)(F)F)ccc3C(F)(F)F)c(N)n2)cc1.
What is the InChIKey of N-[6-amino-5-[2,5-bis(trifluoromethyl)phenyl]-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(3-bromo-2-methoxy-5-methylphenyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(6-chloro-2-fluoro-3-methylphenyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(3-methoxynaphthalen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-[2-methoxy-5-(trifluoromethoxy)phenyl]-2-pyridinyl]-4-methylbenzamide;methyl 3-[2-amino-6-[(4-methylbenzoyl)amino]-3-pyridinyl]-4-chlorobenzoate?
The InChIKey is NZJJEPMJLUBNNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H21N3O2.C21H20BrN3O2.C21H18ClN3O3.C21H15F6N3O.C21H18F3N3O3.C20H17ClFN3O/c1-15-7-9-16(10-8-15)24(28)27-22-12-11-19(23(25)26-22)20-13-17-5-3-4-6-18(17)14-21(20)29-2;1-12-4-6-14(7-5-12)21(26)25-18-9-8-15(20(23)24-18)16-10-13(2)11-17(22)19(16)27-3;1-12-3-5-13(6-4-12)20(26)25-18-10-8-15(19(23)24-18)16-11-14(21(27)28-2)7-9-17(16)22;1-11-2-4-12(5-3-11)19(31)30-17-9-7-14(18(28)29-17)15-10-13(20(22,23)24)6-8-16(15)21(25,26)27;1-12-3-5-13(6-4-12)20(28)27-18-10-8-15(19(25)26-18)16-11-14(30-21(22,23)24)7-9-17(16)29-2;1-11-3-6-13(7-4-11)20(26)25-16-10-8-14(19(23)24-16)17-15(21)9-5-12(2)18(17)22/h3-14H,1-2H3,(H3,25,26,27,28);4-11H,1-3H3,(H3,23,24,25,26);3-11H,1-2H3,(H3,23,24,25,26);2-10H,1H3,(H3,28,29,30,31);3-11H,1-2H3,(H3,25,26,27,28);3-10H,1-2H3,(H3,23,24,25,26).
What are the key properties of N-[6-amino-5-[2,5-bis(trifluoromethyl)phenyl]-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(3-bromo-2-methoxy-5-methylphenyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(6-chloro-2-fluoro-3-methylphenyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(3-methoxynaphthalen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-[2-methoxy-5-(trifluoromethoxy)phenyl]-2-pyridinyl]-4-methylbenzamide;methyl 3-[2-amino-6-[(4-methylbenzoyl)amino]-3-pyridinyl]-4-chlorobenzoate?
N-[6-amino-5-[2,5-bis(trifluoromethyl)phenyl]-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(3-bromo-2-methoxy-5-methylphenyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(6-chloro-2-fluoro-3-methylphenyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(3-methoxynaphthalen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-[2-methoxy-5-(trifluoromethoxy)phenyl]-2-pyridinyl]-4-methylbenzamide;methyl 3-[2-amino-6-[(4-methylbenzoyl)amino]-3-pyridinyl]-4-chlorobenzoate has a molecular weight of 2432.18 g/mol, XLogP of 30.08, 23 rotatable bonds, 12 hydrogen bond donors, and 24 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-amino-5-[2,5-bis(trifluoromethyl)phenyl]-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(3-bromo-2-methoxy-5-methylphenyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(6-chloro-2-fluoro-3-methylphenyl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-(3-methoxynaphthalen-2-yl)-2-pyridinyl]-4-methylbenzamide;N-[6-amino-5-[2-methoxy-5-(trifluoromethoxy)phenyl]-2-pyridinyl]-4-methylbenzamide;methyl 3-[2-amino-6-[(4-methylbenzoyl)amino]-3-pyridinyl]-4-chlorobenzoate is sourced from PubChem (CID 159928863), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).