2-chloro-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-5-(propanoylamino)benzamide;4-chloro-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-3-(trifluoromethyl)benzamide;6-(4-methylpiperazin-1-yl)-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)pyridine-3-carboxamide;6-(4-methylpiperazin-1-yl)-N-(4-methyl-6-pyridin-3-yl-1,3,5-triazin-2-yl)pyridine-3-carboxamide

C76H72Cl2F3N27O5 — CID 158662044

IUPAC2-chloro-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-5-(propanoylamino)benzamide;4-chloro-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-3-(trifluoromethyl)benzamide;6-(4-methylpiperazin-1-yl)-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)pyridine-3-carboxamide;6-(4-methylpiperazin-1-yl)-N-(4-methyl-6-pyridin-3-yl-1,3,5-triazin-2-yl)pyridine-3-carboxamide
SMILESCCC(=O)Nc1ccc(Cl)c(C(=O)Nc2nc(C)nc(-c3ccccn3)n2)c1.Cc1nc(NC(=O)c2ccc(Cl)c(C(F)(F)F)c2)nc(-c2ccccn2)n1.Cc1nc(NC(=O)c2ccc(N3CCN(C)CC3)nc2)nc(-c2ccccn2)n1.Cc1nc(NC(=O)c2ccc(N3CCN(C)CC3)nc2)nc(-c2cccnc2)n1
InChIInChI=1S/2C20H22N8O.C19H17ClN6O2.C17H11ClF3N5O/c1-14-23-18(15-4-3-7-21-12-15)25-20(24-14)26-19(29)16-5-6-17(22-13-16)28-10-8-27(2)9-11-28;1-14-23-18(16-5-3-4-8-21-16)25-20(24-14)26-19(29)15-6-7-17(22-13-15)28-11-9-27(2)10-12-28;1-3-16(27)24-12-7-8-14(20)13(10-12)18(28)26-19-23-11(2)22-17(25-19)15-6-4-5-9-21-15;1-9-23-14(13-4-2-3-7-22-13)25-16(24-9)26-15(27)10-5-6-12(18)11(8-10)17(19,20)21/h3-7,12-13H,8-11H2,1-2H3,(H,23,24,25,26,29);3-8,13H,9-12H2,1-2H3,(H,23,24,25,26,29);4-10H,3H2,1-2H3,(H,24,27)(H,22,23,25,26,28);2-8H,1H3,(H,23,24,25,26,27)
InChIKeyICWKNGJBEZIFMG-UHFFFAOYSA-N
MW1571.50 g/mol
LogP10.94
Rot. Bonds16

About 2-chloro-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-5-(propanoylamino)benzamide;4-chloro-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-3-(trifluoromethyl)benzamide;6-(4-methylpiperazin-1-yl)-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)pyridine-3-carboxamide;6-(4-methylpiperazin-1-yl)-N-(4-methyl-6-pyridin-3-yl-1,3,5-triazin-2-yl)pyridine-3-carboxamide

2-chloro-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-5-(propanoylamino)benzamide;4-chloro-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-3-(trifluoromethyl)benzamide;6-(4-methylpiperazin-1-yl)-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)pyridine-3-carboxamide;6-(4-methylpiperazin-1-yl)-N-(4-methyl-6-pyridin-3-yl-1,3,5-triazin-2-yl)pyridine-3-carboxamide (PubChem CID 158662044) has the molecular formula C76H72Cl2F3N27O5 and a molecular weight of 1571.50 g/mol. Its IUPAC name is 2-chloro-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-5-(propanoylamino)benzamide;4-chloro-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-3-(trifluoromethyl)benzamide;6-(4-methylpiperazin-1-yl)-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)pyridine-3-carboxamide;6-(4-methylpiperazin-1-yl)-N-(4-methyl-6-pyridin-3-yl-1,3,5-triazin-2-yl)pyridine-3-carboxamide.

Molecular Properties

Compound Name2-chloro-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-5-(propanoylamino)benzamide;4-chloro-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-3-(trifluoromethyl)benzamide;6-(4-methylpiperazin-1-yl)-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)pyridine-3-carboxamide;6-(4-methylpiperazin-1-yl)-N-(4-methyl-6-pyridin-3-yl-1,3,5-triazin-2-yl)pyridine-3-carboxamide
PubChem CID158662044
Molecular FormulaC76H72Cl2F3N27O5
Molecular Weight1571.50 g/mol
Exact Mass1569.55
IUPAC Name2-chloro-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-5-(propanoylamino)benzamide;4-chloro-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-3-(trifluoromethyl)benzamide;6-(4-methylpiperazin-1-yl)-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)pyridine-3-carboxamide;6-(4-methylpiperazin-1-yl)-N-(4-methyl-6-pyridin-3-yl-1,3,5-triazin-2-yl)pyridine-3-carboxamide
SMILESCCC(=O)Nc1ccc(Cl)c(C(=O)Nc2nc(C)nc(-c3ccccn3)n2)c1.Cc1nc(NC(=O)c2ccc(Cl)c(C(F)(F)F)c2)nc(-c2ccccn2)n1.Cc1nc(NC(=O)c2ccc(N3CCN(C)CC3)nc2)nc(-c2ccccn2)n1.Cc1nc(NC(=O)c2ccc(N3CCN(C)CC3)nc2)nc(-c2cccnc2)n1
InChIInChI=1S/2C20H22N8O.C19H17ClN6O2.C17H11ClF3N5O/c1-14-23-18(15-4-3-7-21-12-15)25-20(24-14)26-19(29)16-5-6-17(22-13-16)28-10-8-27(2)9-11-28;1-14-23-18(16-5-3-4-8-21-16)25-20(24-14)26-19(29)15-6-7-17(22-13-15)28-11-9-27(2)10-12-28;1-3-16(27)24-12-7-8-14(20)13(10-12)18(28)26-19-23-11(2)22-17(25-19)15-6-4-5-9-21-15;1-9-23-14(13-4-2-3-7-22-13)25-16(24-9)26-15(27)10-5-6-12(18)11(8-10)17(19,20)21/h3-7,12-13H,8-11H2,1-2H3,(H,23,24,25,26,29);3-8,13H,9-12H2,1-2H3,(H,23,24,25,26,29);4-10H,3H2,1-2H3,(H,24,27)(H,22,23,25,26,28);2-8H,1H3,(H,23,24,25,26,27)
InChIKeyICWKNGJBEZIFMG-UHFFFAOYSA-N
XLogP10.94
TPSA390.48 Ų
H-Bond Donors5
H-Bond Acceptors27
Rotatable Bonds16
Heavy Atoms113
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001571.50
LogP ≤ 510.94
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1027

Analyze 2-chloro-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-5-(propanoylamino)benzamide;4-chloro-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-3-(trifluoromethyl)benzamide;6-(4-methylpiperazin-1-yl)-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)pyridine-3-carboxamide;6-(4-methylpiperazin-1-yl)-N-(4-methyl-6-pyridin-3-yl-1,3,5-triazin-2-yl)pyridine-3-carboxamide 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

4-[[4-Chloro-3-(trifluoromethyl)phenyl]methylamino]-6-(pyridine-4-carbonylamino)quinazoline-8-carboxamide
CID 66762611
N-[(E)-[4-chloro-3-(trifluoromethyl)phenyl]methylideneamino]-2-[[3-(8,9-dihydro-6H-pyrido[4,3-b][1,8]naphthyridin-7-ylmethyl)benzoyl]amino]-5-piperidin-1-ylbenzamide
CID 23108194
2-Chloro-N-(2-(pyridin-3-ylamino)pyrimidin-5-yl)-5-(3-(trifluoromethyl)benzamido)benzamide
CID 24961098
2-chloro-N-[2-[[6-(4-propylpiperazine-1-carbonyl)-3-pyridinyl]amino]pyrimidin-5-yl]-5-[[3-(trifluoromethyl)benzoyl]amino]benzamide
CID 59652693
N-(4-chloro-3-pyrido[2,3-b]pyrazin-3-ylphenyl)-2-methyl-6-(trifluoromethyl)pyridine-3-carboxamide
CID 59826545
N-[[4-chloro-3-(trifluoromethyl)phenyl]methylideneamino]-2-[[3-(8,9-dihydro-6H-pyrido[4,3-b][1,8]naphthyridin-7-ylmethyl)benzoyl]amino]-5-piperidin-1-ylbenzamide
CID 66639206
N-[(Z)-[4-chloro-3-(trifluoromethyl)phenyl]methylideneamino]-2-[[3-(8,9-dihydro-6H-pyrido[4,3-b][1,8]naphthyridin-7-ylmethyl)benzoyl]amino]-5-piperidin-1-ylbenzamide
CID 66640677
2-[3-[2-[2-amino-4-[1-(1-methylpiperidin-4-yl)-4-oxo-6,7-dihydro-5H-pyrrolo[3,2-c]pyridin-2-yl]pyrimidin-5-yl]ethynyl]phenyl]-N-[4-chloro-3-(trifluoromethyl)phenyl]acetamide
CID 75201935
N-[amino-[4-(2-chloro-3-pyridinyl)-5-fluoropyrimidin-2-yl]methyl]-3-[[3-[5-fluoro-2-(methylamino)pyrimidin-4-yl]-2-pyridinyl]amino]-4-methyl-N-(3-propan-2-ylphenyl)benzamide
CID 87220097
2-chloro-N-[1-(7-chloroquinazolin-4-yl)piperidin-4-yl]pyridine-3-carboxamide;N-[1-(7-chloroquinazolin-4-yl)piperidin-4-yl]-2-fluoro-3-(trifluoromethyl)benzamide
CID 87610811
N-[4-chloro-3-[2-[2-(dimethylamino)ethylamino]-8-methoxy-7-oxopyrido[2,3-d]pyrimidin-6-yl]phenyl]-2-morpholin-4-ylpyridine-4-carboxamide;N-[4-chloro-3-[2-[2-(dimethylamino)ethylamino]-8-methoxy-7-oxopyrido[2,3-d]pyrimidin-6-yl]phenyl]-2-[3-(trifluoromethyl)phenyl]acetamide
CID 87671281
4-chloro-3-[2-[2-(dimethylamino)ethylamino]-8-methoxy-7-oxopyrido[2,3-d]pyrimidin-6-yl]benzamide;N-[4-chloro-3-[2-[2-(dimethylamino)ethylamino]-8-methoxy-7-oxopyrido[2,3-d]pyrimidin-6-yl]phenyl]-3-fluoro-4-(trifluoromethyl)benzamide
CID 87671656

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-5-(propanoylamino)benzamide;4-chloro-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-3-(trifluoromethyl)benzamide;6-(4-methylpiperazin-1-yl)-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)pyridine-3-carboxamide;6-(4-methylpiperazin-1-yl)-N-(4-methyl-6-pyridin-3-yl-1,3,5-triazin-2-yl)pyridine-3-carboxamide?
The IUPAC name of 2-chloro-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-5-(propanoylamino)benzamide;4-chloro-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-3-(trifluoromethyl)benzamide;6-(4-methylpiperazin-1-yl)-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)pyridine-3-carboxamide;6-(4-methylpiperazin-1-yl)-N-(4-methyl-6-pyridin-3-yl-1,3,5-triazin-2-yl)pyridine-3-carboxamide (CID 158662044) is 2-chloro-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-5-(propanoylamino)benzamide;4-chloro-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-3-(trifluoromethyl)benzamide;6-(4-methylpiperazin-1-yl)-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)pyridine-3-carboxamide;6-(4-methylpiperazin-1-yl)-N-(4-methyl-6-pyridin-3-yl-1,3,5-triazin-2-yl)pyridine-3-carboxamide.
What is the SMILES notation for 2-chloro-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-5-(propanoylamino)benzamide;4-chloro-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-3-(trifluoromethyl)benzamide;6-(4-methylpiperazin-1-yl)-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)pyridine-3-carboxamide;6-(4-methylpiperazin-1-yl)-N-(4-methyl-6-pyridin-3-yl-1,3,5-triazin-2-yl)pyridine-3-carboxamide?
The canonical SMILES for 2-chloro-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-5-(propanoylamino)benzamide;4-chloro-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-3-(trifluoromethyl)benzamide;6-(4-methylpiperazin-1-yl)-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)pyridine-3-carboxamide;6-(4-methylpiperazin-1-yl)-N-(4-methyl-6-pyridin-3-yl-1,3,5-triazin-2-yl)pyridine-3-carboxamide is CCC(=O)Nc1ccc(Cl)c(C(=O)Nc2nc(C)nc(-c3ccccn3)n2)c1.Cc1nc(NC(=O)c2ccc(Cl)c(C(F)(F)F)c2)nc(-c2ccccn2)n1.Cc1nc(NC(=O)c2ccc(N3CCN(C)CC3)nc2)nc(-c2ccccn2)n1.Cc1nc(NC(=O)c2ccc(N3CCN(C)CC3)nc2)nc(-c2cccnc2)n1.
What is the InChIKey of 2-chloro-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-5-(propanoylamino)benzamide;4-chloro-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-3-(trifluoromethyl)benzamide;6-(4-methylpiperazin-1-yl)-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)pyridine-3-carboxamide;6-(4-methylpiperazin-1-yl)-N-(4-methyl-6-pyridin-3-yl-1,3,5-triazin-2-yl)pyridine-3-carboxamide?
The InChIKey is ICWKNGJBEZIFMG-UHFFFAOYSA-N. The full InChI is InChI=1S/2C20H22N8O.C19H17ClN6O2.C17H11ClF3N5O/c1-14-23-18(15-4-3-7-21-12-15)25-20(24-14)26-19(29)16-5-6-17(22-13-16)28-10-8-27(2)9-11-28;1-14-23-18(16-5-3-4-8-21-16)25-20(24-14)26-19(29)15-6-7-17(22-13-15)28-11-9-27(2)10-12-28;1-3-16(27)24-12-7-8-14(20)13(10-12)18(28)26-19-23-11(2)22-17(25-19)15-6-4-5-9-21-15;1-9-23-14(13-4-2-3-7-22-13)25-16(24-9)26-15(27)10-5-6-12(18)11(8-10)17(19,20)21/h3-7,12-13H,8-11H2,1-2H3,(H,23,24,25,26,29);3-8,13H,9-12H2,1-2H3,(H,23,24,25,26,29);4-10H,3H2,1-2H3,(H,24,27)(H,22,23,25,26,28);2-8H,1H3,(H,23,24,25,26,27).
What are the key properties of 2-chloro-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-5-(propanoylamino)benzamide;4-chloro-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-3-(trifluoromethyl)benzamide;6-(4-methylpiperazin-1-yl)-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)pyridine-3-carboxamide;6-(4-methylpiperazin-1-yl)-N-(4-methyl-6-pyridin-3-yl-1,3,5-triazin-2-yl)pyridine-3-carboxamide?
2-chloro-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-5-(propanoylamino)benzamide;4-chloro-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-3-(trifluoromethyl)benzamide;6-(4-methylpiperazin-1-yl)-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)pyridine-3-carboxamide;6-(4-methylpiperazin-1-yl)-N-(4-methyl-6-pyridin-3-yl-1,3,5-triazin-2-yl)pyridine-3-carboxamide has a molecular weight of 1571.50 g/mol, XLogP of 10.94, 16 rotatable bonds, 5 hydrogen bond donors, and 27 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-5-(propanoylamino)benzamide;4-chloro-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)-3-(trifluoromethyl)benzamide;6-(4-methylpiperazin-1-yl)-N-(4-methyl-6-pyridin-2-yl-1,3,5-triazin-2-yl)pyridine-3-carboxamide;6-(4-methylpiperazin-1-yl)-N-(4-methyl-6-pyridin-3-yl-1,3,5-triazin-2-yl)pyridine-3-carboxamide is sourced from PubChem (CID 158662044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).