2-amino-N-(4-chloro-3-pyridin-2-ylphenyl)pyridine-3-carboxamide;N-benzyl-5-chloro-4-pyridin-2-yl-1,3-thiazol-2-amine;N-[3-[3,5-bis(trifluoromethyl)phenyl]propyl]-4-chloro-3-pyridin-2-ylaniline;4-chloro-N-(3,5-dimethoxyphenyl)-3-pyridin-2-ylbenzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-methoxybenzamide

C93H74Cl5F6N13O6S — CID 157245324

IUPAC2-amino-N-(4-chloro-3-pyridin-2-ylphenyl)pyridine-3-carboxamide;N-benzyl-5-chloro-4-pyridin-2-yl-1,3-thiazol-2-amine;N-[3-[3,5-bis(trifluoromethyl)phenyl]propyl]-4-chloro-3-pyridin-2-ylaniline;4-chloro-N-(3,5-dimethoxyphenyl)-3-pyridin-2-ylbenzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-methoxybenzamide
SMILESCOc1cc(NC(=O)c2ccc(Cl)c(-c3ccccn3)c2)cc(OC)c1.COc1ccc(C(=O)Nc2ccc(Cl)c(-c3ccccn3)c2)cc1.Clc1sc(NCc2ccccc2)nc1-c1ccccn1.FC(F)(F)c1cc(CCCNc2ccc(Cl)c(-c3ccccn3)c2)cc(C(F)(F)F)c1.Nc1ncccc1C(=O)Nc1ccc(Cl)c(-c2ccccn2)c1
InChIInChI=1S/C22H17ClF6N2.C20H17ClN2O3.C19H15ClN2O2.C17H13ClN4O.C15H12ClN3S/c23-19-7-6-17(13-18(19)20-5-1-2-8-31-20)30-9-3-4-14-10-15(21(24,25)26)12-16(11-14)22(27,28)29;1-25-15-10-14(11-16(12-15)26-2)23-20(24)13-6-7-18(21)17(9-13)19-5-3-4-8-22-19;1-24-15-8-5-13(6-9-15)19(23)22-14-7-10-17(20)16(12-14)18-4-2-3-11-21-18;18-14-7-6-11(10-13(14)15-5-1-2-8-20-15)22-17(23)12-4-3-9-21-16(12)19;16-14-13(12-8-4-5-9-17-12)19-15(20-14)18-10-11-6-2-1-3-7-11/h1-2,5-8,10-13,30H,3-4,9H2;3-12H,1-2H3,(H,23,24);2-12H,1H3,(H,22,23);1-10H,(H2,19,21)(H,22,23);1-9H,10H2,(H,18,19)
InChIKeyAVRQDOOTHHVLPY-UHFFFAOYSA-N
MW1793.02 g/mol
LogP24.92
Rot. Bonds22

About 2-amino-N-(4-chloro-3-pyridin-2-ylphenyl)pyridine-3-carboxamide;N-benzyl-5-chloro-4-pyridin-2-yl-1,3-thiazol-2-amine;N-[3-[3,5-bis(trifluoromethyl)phenyl]propyl]-4-chloro-3-pyridin-2-ylaniline;4-chloro-N-(3,5-dimethoxyphenyl)-3-pyridin-2-ylbenzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-methoxybenzamide

2-amino-N-(4-chloro-3-pyridin-2-ylphenyl)pyridine-3-carboxamide;N-benzyl-5-chloro-4-pyridin-2-yl-1,3-thiazol-2-amine;N-[3-[3,5-bis(trifluoromethyl)phenyl]propyl]-4-chloro-3-pyridin-2-ylaniline;4-chloro-N-(3,5-dimethoxyphenyl)-3-pyridin-2-ylbenzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-methoxybenzamide (PubChem CID 157245324) has the molecular formula C93H74Cl5F6N13O6S and a molecular weight of 1793.02 g/mol. Its IUPAC name is 2-amino-N-(4-chloro-3-pyridin-2-ylphenyl)pyridine-3-carboxamide;N-benzyl-5-chloro-4-pyridin-2-yl-1,3-thiazol-2-amine;N-[3-[3,5-bis(trifluoromethyl)phenyl]propyl]-4-chloro-3-pyridin-2-ylaniline;4-chloro-N-(3,5-dimethoxyphenyl)-3-pyridin-2-ylbenzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-methoxybenzamide.

Molecular Properties

Compound Name2-amino-N-(4-chloro-3-pyridin-2-ylphenyl)pyridine-3-carboxamide;N-benzyl-5-chloro-4-pyridin-2-yl-1,3-thiazol-2-amine;N-[3-[3,5-bis(trifluoromethyl)phenyl]propyl]-4-chloro-3-pyridin-2-ylaniline;4-chloro-N-(3,5-dimethoxyphenyl)-3-pyridin-2-ylbenzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-methoxybenzamide
PubChem CID157245324
Molecular FormulaC93H74Cl5F6N13O6S
Molecular Weight1793.02 g/mol
Exact Mass1789.40
IUPAC Name2-amino-N-(4-chloro-3-pyridin-2-ylphenyl)pyridine-3-carboxamide;N-benzyl-5-chloro-4-pyridin-2-yl-1,3-thiazol-2-amine;N-[3-[3,5-bis(trifluoromethyl)phenyl]propyl]-4-chloro-3-pyridin-2-ylaniline;4-chloro-N-(3,5-dimethoxyphenyl)-3-pyridin-2-ylbenzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-methoxybenzamide
SMILESCOc1cc(NC(=O)c2ccc(Cl)c(-c3ccccn3)c2)cc(OC)c1.COc1ccc(C(=O)Nc2ccc(Cl)c(-c3ccccn3)c2)cc1.Clc1sc(NCc2ccccc2)nc1-c1ccccn1.FC(F)(F)c1cc(CCCNc2ccc(Cl)c(-c3ccccn3)c2)cc(C(F)(F)F)c1.Nc1ncccc1C(=O)Nc1ccc(Cl)c(-c2ccccn2)c1
InChIInChI=1S/C22H17ClF6N2.C20H17ClN2O3.C19H15ClN2O2.C17H13ClN4O.C15H12ClN3S/c23-19-7-6-17(13-18(19)20-5-1-2-8-31-20)30-9-3-4-14-10-15(21(24,25)26)12-16(11-14)22(27,28)29;1-25-15-10-14(11-16(12-15)26-2)23-20(24)13-6-7-18(21)17(9-13)19-5-3-4-8-22-19;1-24-15-8-5-13(6-9-15)19(23)22-14-7-10-17(20)16(12-14)18-4-2-3-11-21-18;18-14-7-6-11(10-13(14)15-5-1-2-8-20-15)22-17(23)12-4-3-9-21-16(12)19;16-14-13(12-8-4-5-9-17-12)19-15(20-14)18-10-11-6-2-1-3-7-11/h1-2,5-8,10-13,30H,3-4,9H2;3-12H,1-2H3,(H,23,24);2-12H,1H3,(H,22,23);1-10H,(H2,19,21)(H,22,23);1-9H,10H2,(H,18,19)
InChIKeyAVRQDOOTHHVLPY-UHFFFAOYSA-N
XLogP24.92
TPSA255.30 Ų
H-Bond Donors6
H-Bond Acceptors17
Rotatable Bonds22
Heavy Atoms124
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001793.02
LogP ≤ 524.92
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1017

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 2-amino-N-(4-chloro-3-pyridin-2-ylphenyl)pyridine-3-carboxamide;N-benzyl-5-chloro-4-pyridin-2-yl-1,3-thiazol-2-amine;N-[3-[3,5-bis(trifluoromethyl)phenyl]propyl]-4-chloro-3-pyridin-2-ylaniline;4-chloro-N-(3,5-dimethoxyphenyl)-3-pyridin-2-ylbenzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-methoxybenzamide with MolForge

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Related Compounds

2-amino-N-(4-chloro-3-pyridin-2-ylphenyl)pyridine-3-carboxamide;N-benzyl-5-chloro-4-pyridin-2-yl-1,3-thiazol-2-amine;4-chloro-N-(3,5-dimethoxyphenyl)-3-pyridin-2-ylbenzamide;4-chloro-N-[3-[3-methyl-5-(trifluoromethyl)phenyl]propyl]-3-pyridin-2-ylaniline;N-(4-chloro-3-pyridin-2-ylphenyl)-4-methoxybenzamide
CID 157694150
N-benzyl-5-chloro-4-pyridin-2-yl-1,3-thiazol-2-amine;4-chloro-N-(3,5-dimethoxyphenyl)-3-pyridin-2-ylbenzamide;N-[1-(3-chloro-5-methyl-2-pyridinyl)-1,2,4-triazol-3-yl]-3-methoxy-5-methylbenzamide;4-chloro-N-[3-[3-methyl-5-(trifluoromethyl)phenyl]propyl]-3-pyridin-2-ylaniline;N-(4-chloro-3-pyridin-2-ylphenyl)-4-methoxybenzamide
CID 160068756
N-benzyl-5-chloro-4-pyridin-2-yl-1,3-thiazol-2-amine;4-chloro-N-(3,5-dimethoxyphenyl)-3-pyridin-2-ylbenzamide;N-[1-(3-chloro-5-methyl-2-pyridinyl)-1,2,4-triazol-3-yl]-3-methoxy-5-methylbenzamide;4-chloro-N-[3-[3-methyl-5-(trifluoromethyl)phenyl]propyl]-3-pyridin-2-ylaniline
CID 160637304
2-amino-N-(4-chloro-3-pyridin-2-ylphenyl)pyridine-3-carboxamide;N-benzyl-5-chloro-4-pyridin-2-yl-1,3-thiazol-2-amine;2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-5-methylsulfonylbenzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-methoxybenzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-3-methylsulfonylbenzamide
CID 158058134
2-amino-N-(4-chloro-3-pyridin-2-ylphenyl)pyridine-3-carboxamide;N-benzyl-5-chloro-4-pyridin-2-yl-1,3-thiazol-2-amine;N-(4-chloro-3-pyridin-2-ylphenyl)-3,5-dimethoxybenzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-methoxybenzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-3-methylsulfonylbenzamide
CID 161739933
2-amino-N-(4-chloro-3-pyridin-2-ylphenyl)pyridine-3-carboxamide;N-benzyl-5-chloro-4-pyridin-2-yl-1,3-thiazol-2-amine;2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-5-methylsulfonylbenzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-methoxybenzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-3-methylsulfonylbenzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-3-methylthiophene-2-carboxamide
CID 162150318

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(4-chloro-3-pyridin-2-ylphenyl)pyridine-3-carboxamide;N-benzyl-5-chloro-4-pyridin-2-yl-1,3-thiazol-2-amine;N-[3-[3,5-bis(trifluoromethyl)phenyl]propyl]-4-chloro-3-pyridin-2-ylaniline;4-chloro-N-(3,5-dimethoxyphenyl)-3-pyridin-2-ylbenzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-methoxybenzamide?
The IUPAC name of 2-amino-N-(4-chloro-3-pyridin-2-ylphenyl)pyridine-3-carboxamide;N-benzyl-5-chloro-4-pyridin-2-yl-1,3-thiazol-2-amine;N-[3-[3,5-bis(trifluoromethyl)phenyl]propyl]-4-chloro-3-pyridin-2-ylaniline;4-chloro-N-(3,5-dimethoxyphenyl)-3-pyridin-2-ylbenzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-methoxybenzamide (CID 157245324) is 2-amino-N-(4-chloro-3-pyridin-2-ylphenyl)pyridine-3-carboxamide;N-benzyl-5-chloro-4-pyridin-2-yl-1,3-thiazol-2-amine;N-[3-[3,5-bis(trifluoromethyl)phenyl]propyl]-4-chloro-3-pyridin-2-ylaniline;4-chloro-N-(3,5-dimethoxyphenyl)-3-pyridin-2-ylbenzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-methoxybenzamide.
What is the SMILES notation for 2-amino-N-(4-chloro-3-pyridin-2-ylphenyl)pyridine-3-carboxamide;N-benzyl-5-chloro-4-pyridin-2-yl-1,3-thiazol-2-amine;N-[3-[3,5-bis(trifluoromethyl)phenyl]propyl]-4-chloro-3-pyridin-2-ylaniline;4-chloro-N-(3,5-dimethoxyphenyl)-3-pyridin-2-ylbenzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-methoxybenzamide?
The canonical SMILES for 2-amino-N-(4-chloro-3-pyridin-2-ylphenyl)pyridine-3-carboxamide;N-benzyl-5-chloro-4-pyridin-2-yl-1,3-thiazol-2-amine;N-[3-[3,5-bis(trifluoromethyl)phenyl]propyl]-4-chloro-3-pyridin-2-ylaniline;4-chloro-N-(3,5-dimethoxyphenyl)-3-pyridin-2-ylbenzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-methoxybenzamide is COc1cc(NC(=O)c2ccc(Cl)c(-c3ccccn3)c2)cc(OC)c1.COc1ccc(C(=O)Nc2ccc(Cl)c(-c3ccccn3)c2)cc1.Clc1sc(NCc2ccccc2)nc1-c1ccccn1.FC(F)(F)c1cc(CCCNc2ccc(Cl)c(-c3ccccn3)c2)cc(C(F)(F)F)c1.Nc1ncccc1C(=O)Nc1ccc(Cl)c(-c2ccccn2)c1.
What is the InChIKey of 2-amino-N-(4-chloro-3-pyridin-2-ylphenyl)pyridine-3-carboxamide;N-benzyl-5-chloro-4-pyridin-2-yl-1,3-thiazol-2-amine;N-[3-[3,5-bis(trifluoromethyl)phenyl]propyl]-4-chloro-3-pyridin-2-ylaniline;4-chloro-N-(3,5-dimethoxyphenyl)-3-pyridin-2-ylbenzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-methoxybenzamide?
The InChIKey is AVRQDOOTHHVLPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H17ClF6N2.C20H17ClN2O3.C19H15ClN2O2.C17H13ClN4O.C15H12ClN3S/c23-19-7-6-17(13-18(19)20-5-1-2-8-31-20)30-9-3-4-14-10-15(21(24,25)26)12-16(11-14)22(27,28)29;1-25-15-10-14(11-16(12-15)26-2)23-20(24)13-6-7-18(21)17(9-13)19-5-3-4-8-22-19;1-24-15-8-5-13(6-9-15)19(23)22-14-7-10-17(20)16(12-14)18-4-2-3-11-21-18;18-14-7-6-11(10-13(14)15-5-1-2-8-20-15)22-17(23)12-4-3-9-21-16(12)19;16-14-13(12-8-4-5-9-17-12)19-15(20-14)18-10-11-6-2-1-3-7-11/h1-2,5-8,10-13,30H,3-4,9H2;3-12H,1-2H3,(H,23,24);2-12H,1H3,(H,22,23);1-10H,(H2,19,21)(H,22,23);1-9H,10H2,(H,18,19).
What are the key properties of 2-amino-N-(4-chloro-3-pyridin-2-ylphenyl)pyridine-3-carboxamide;N-benzyl-5-chloro-4-pyridin-2-yl-1,3-thiazol-2-amine;N-[3-[3,5-bis(trifluoromethyl)phenyl]propyl]-4-chloro-3-pyridin-2-ylaniline;4-chloro-N-(3,5-dimethoxyphenyl)-3-pyridin-2-ylbenzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-methoxybenzamide?
2-amino-N-(4-chloro-3-pyridin-2-ylphenyl)pyridine-3-carboxamide;N-benzyl-5-chloro-4-pyridin-2-yl-1,3-thiazol-2-amine;N-[3-[3,5-bis(trifluoromethyl)phenyl]propyl]-4-chloro-3-pyridin-2-ylaniline;4-chloro-N-(3,5-dimethoxyphenyl)-3-pyridin-2-ylbenzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-methoxybenzamide has a molecular weight of 1793.02 g/mol, XLogP of 24.92, 22 rotatable bonds, 6 hydrogen bond donors, and 17 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(4-chloro-3-pyridin-2-ylphenyl)pyridine-3-carboxamide;N-benzyl-5-chloro-4-pyridin-2-yl-1,3-thiazol-2-amine;N-[3-[3,5-bis(trifluoromethyl)phenyl]propyl]-4-chloro-3-pyridin-2-ylaniline;4-chloro-N-(3,5-dimethoxyphenyl)-3-pyridin-2-ylbenzamide;N-(4-chloro-3-pyridin-2-ylphenyl)-4-methoxybenzamide is sourced from PubChem (CID 157245324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).