4-(3-chloro-2-pyridinyl)-2-methyl-N-(3-methylphenyl)piperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-2-methyl-N-(4-methylphenyl)piperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-N-(3-methylphenyl)piperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-N-(4-methylphenyl)piperazine-1-carboxamide;2-methyl-N-(3-methylphenyl)-4-[3-(trifluoromethyl)-2-pyridinyl]piperazine-1-carboxamide;2-methyl-N-(4-methylphenyl)-4-[3-(trifluoromethyl)-2-pyridinyl]piperazine-1-carboxamide;N-(4-methylphenyl)-4-[3-(trifluoromethyl)-2-pyridinyl]piperazine-1-carboxamide

C126H141Cl4F9N28O7 — CID 161078256

IUPAC4-(3-chloro-2-pyridinyl)-2-methyl-N-(3-methylphenyl)piperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-2-methyl-N-(4-methylphenyl)piperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-N-(3-methylphenyl)piperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-N-(4-methylphenyl)piperazine-1-carboxamide;2-methyl-N-(3-methylphenyl)-4-[3-(trifluoromethyl)-2-pyridinyl]piperazine-1-carboxamide;2-methyl-N-(4-methylphenyl)-4-[3-(trifluoromethyl)-2-pyridinyl]piperazine-1-carboxamide;N-(4-methylphenyl)-4-[3-(trifluoromethyl)-2-pyridinyl]piperazine-1-carboxamide
SMILESCc1ccc(NC(=O)N2CCN(c3ncccc3C(F)(F)F)CC2)cc1.Cc1ccc(NC(=O)N2CCN(c3ncccc3C(F)(F)F)CC2C)cc1.Cc1ccc(NC(=O)N2CCN(c3ncccc3Cl)CC2)cc1.Cc1ccc(NC(=O)N2CCN(c3ncccc3Cl)CC2C)cc1.Cc1cccc(NC(=O)N2CCN(c3ncccc3C(F)(F)F)CC2C)c1.Cc1cccc(NC(=O)N2CCN(c3ncccc3Cl)CC2)c1.Cc1cccc(NC(=O)N2CCN(c3ncccc3Cl)CC2C)c1
InChIInChI=1S/2C19H21F3N4O.2C18H21ClN4O.C18H19F3N4O.2C17H19ClN4O/c1-13-5-3-6-15(11-13)24-18(27)26-10-9-25(12-14(26)2)17-16(19(20,21)22)7-4-8-23-17;1-13-5-7-15(8-6-13)24-18(27)26-11-10-25(12-14(26)2)17-16(19(20,21)22)4-3-9-23-17;1-13-5-3-6-15(11-13)21-18(24)23-10-9-22(12-14(23)2)17-16(19)7-4-8-20-17;1-13-5-7-15(8-6-13)21-18(24)23-11-10-22(12-14(23)2)17-16(19)4-3-9-20-17;1-13-4-6-14(7-5-13)23-17(26)25-11-9-24(10-12-25)16-15(18(19,20)21)3-2-8-22-16;1-13-4-2-5-14(12-13)20-17(23)22-10-8-21(9-11-22)16-15(18)6-3-7-19-16;1-13-4-6-14(7-5-13)20-17(23)22-11-9-21(10-12-22)16-15(18)3-2-8-19-16/h3-8,11,14H,9-10,12H2,1-2H3,(H,24,27);3-9,14H,10-12H2,1-2H3,(H,24,27);3-8,11,14H,9-10,12H2,1-2H3,(H,21,24);3-9,14H,10-12H2,1-2H3,(H,21,24);2-8H,9-12H2,1H3,(H,23,26);2-7,12H,8-11H2,1H3,(H,20,23);2-8H,9-12H2,1H3,(H,20,23)
InChIKeyUFOLFCKQHNQOEU-UHFFFAOYSA-N
MW2472.50 g/mol
LogP26.43
Rot. Bonds14

About 4-(3-chloro-2-pyridinyl)-2-methyl-N-(3-methylphenyl)piperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-2-methyl-N-(4-methylphenyl)piperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-N-(3-methylphenyl)piperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-N-(4-methylphenyl)piperazine-1-carboxamide;2-methyl-N-(3-methylphenyl)-4-[3-(trifluoromethyl)-2-pyridinyl]piperazine-1-carboxamide;2-methyl-N-(4-methylphenyl)-4-[3-(trifluoromethyl)-2-pyridinyl]piperazine-1-carboxamide;N-(4-methylphenyl)-4-[3-(trifluoromethyl)-2-pyridinyl]piperazine-1-carboxamide

4-(3-chloro-2-pyridinyl)-2-methyl-N-(3-methylphenyl)piperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-2-methyl-N-(4-methylphenyl)piperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-N-(3-methylphenyl)piperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-N-(4-methylphenyl)piperazine-1-carboxamide;2-methyl-N-(3-methylphenyl)-4-[3-(trifluoromethyl)-2-pyridinyl]piperazine-1-carboxamide;2-methyl-N-(4-methylphenyl)-4-[3-(trifluoromethyl)-2-pyridinyl]piperazine-1-carboxamide;N-(4-methylphenyl)-4-[3-(trifluoromethyl)-2-pyridinyl]piperazine-1-carboxamide (PubChem CID 161078256) has the molecular formula C126H141Cl4F9N28O7 and a molecular weight of 2472.50 g/mol. Its IUPAC name is 4-(3-chloro-2-pyridinyl)-2-methyl-N-(3-methylphenyl)piperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-2-methyl-N-(4-methylphenyl)piperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-N-(3-methylphenyl)piperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-N-(4-methylphenyl)piperazine-1-carboxamide;2-methyl-N-(3-methylphenyl)-4-[3-(trifluoromethyl)-2-pyridinyl]piperazine-1-carboxamide;2-methyl-N-(4-methylphenyl)-4-[3-(trifluoromethyl)-2-pyridinyl]piperazine-1-carboxamide;N-(4-methylphenyl)-4-[3-(trifluoromethyl)-2-pyridinyl]piperazine-1-carboxamide.

Molecular Properties

Compound Name4-(3-chloro-2-pyridinyl)-2-methyl-N-(3-methylphenyl)piperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-2-methyl-N-(4-methylphenyl)piperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-N-(3-methylphenyl)piperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-N-(4-methylphenyl)piperazine-1-carboxamide;2-methyl-N-(3-methylphenyl)-4-[3-(trifluoromethyl)-2-pyridinyl]piperazine-1-carboxamide;2-methyl-N-(4-methylphenyl)-4-[3-(trifluoromethyl)-2-pyridinyl]piperazine-1-carboxamide;N-(4-methylphenyl)-4-[3-(trifluoromethyl)-2-pyridinyl]piperazine-1-carboxamide
PubChem CID161078256
Molecular FormulaC126H141Cl4F9N28O7
Molecular Weight2472.50 g/mol
Exact Mass2469.01
IUPAC Name4-(3-chloro-2-pyridinyl)-2-methyl-N-(3-methylphenyl)piperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-2-methyl-N-(4-methylphenyl)piperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-N-(3-methylphenyl)piperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-N-(4-methylphenyl)piperazine-1-carboxamide;2-methyl-N-(3-methylphenyl)-4-[3-(trifluoromethyl)-2-pyridinyl]piperazine-1-carboxamide;2-methyl-N-(4-methylphenyl)-4-[3-(trifluoromethyl)-2-pyridinyl]piperazine-1-carboxamide;N-(4-methylphenyl)-4-[3-(trifluoromethyl)-2-pyridinyl]piperazine-1-carboxamide
SMILESCc1ccc(NC(=O)N2CCN(c3ncccc3C(F)(F)F)CC2)cc1.Cc1ccc(NC(=O)N2CCN(c3ncccc3C(F)(F)F)CC2C)cc1.Cc1ccc(NC(=O)N2CCN(c3ncccc3Cl)CC2)cc1.Cc1ccc(NC(=O)N2CCN(c3ncccc3Cl)CC2C)cc1.Cc1cccc(NC(=O)N2CCN(c3ncccc3C(F)(F)F)CC2C)c1.Cc1cccc(NC(=O)N2CCN(c3ncccc3Cl)CC2)c1.Cc1cccc(NC(=O)N2CCN(c3ncccc3Cl)CC2C)c1
InChIInChI=1S/2C19H21F3N4O.2C18H21ClN4O.C18H19F3N4O.2C17H19ClN4O/c1-13-5-3-6-15(11-13)24-18(27)26-10-9-25(12-14(26)2)17-16(19(20,21)22)7-4-8-23-17;1-13-5-7-15(8-6-13)24-18(27)26-11-10-25(12-14(26)2)17-16(19(20,21)22)4-3-9-23-17;1-13-5-3-6-15(11-13)21-18(24)23-10-9-22(12-14(23)2)17-16(19)7-4-8-20-17;1-13-5-7-15(8-6-13)21-18(24)23-11-10-22(12-14(23)2)17-16(19)4-3-9-20-17;1-13-4-6-14(7-5-13)23-17(26)25-11-9-24(10-12-25)16-15(18(19,20)21)3-2-8-22-16;1-13-4-2-5-14(12-13)20-17(23)22-10-8-21(9-11-22)16-15(18)6-3-7-19-16;1-13-4-6-14(7-5-13)20-17(23)22-11-9-21(10-12-22)16-15(18)3-2-8-19-16/h3-8,11,14H,9-10,12H2,1-2H3,(H,24,27);3-9,14H,10-12H2,1-2H3,(H,24,27);3-8,11,14H,9-10,12H2,1-2H3,(H,21,24);3-9,14H,10-12H2,1-2H3,(H,21,24);2-8H,9-12H2,1H3,(H,23,26);2-7,12H,8-11H2,1H3,(H,20,23);2-8H,9-12H2,1H3,(H,20,23)
InChIKeyUFOLFCKQHNQOEU-UHFFFAOYSA-N
XLogP26.43
TPSA339.29 Ų
H-Bond Donors7
H-Bond Acceptors21
Rotatable Bonds14
Heavy Atoms174
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002472.50
LogP ≤ 526.43
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1021

Analyze 4-(3-chloro-2-pyridinyl)-2-methyl-N-(3-methylphenyl)piperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-2-methyl-N-(4-methylphenyl)piperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-N-(3-methylphenyl)piperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-N-(4-methylphenyl)piperazine-1-carboxamide;2-methyl-N-(3-methylphenyl)-4-[3-(trifluoromethyl)-2-pyridinyl]piperazine-1-carboxamide;2-methyl-N-(4-methylphenyl)-4-[3-(trifluoromethyl)-2-pyridinyl]piperazine-1-carboxamide;N-(4-methylphenyl)-4-[3-(trifluoromethyl)-2-pyridinyl]piperazine-1-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 4-(3-chloro-2-pyridinyl)-2-methyl-N-(3-methylphenyl)piperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-2-methyl-N-(4-methylphenyl)piperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-N-(3-methylphenyl)piperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-N-(4-methylphenyl)piperazine-1-carboxamide;2-methyl-N-(3-methylphenyl)-4-[3-(trifluoromethyl)-2-pyridinyl]piperazine-1-carboxamide;2-methyl-N-(4-methylphenyl)-4-[3-(trifluoromethyl)-2-pyridinyl]piperazine-1-carboxamide;N-(4-methylphenyl)-4-[3-(trifluoromethyl)-2-pyridinyl]piperazine-1-carboxamide?
The IUPAC name of 4-(3-chloro-2-pyridinyl)-2-methyl-N-(3-methylphenyl)piperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-2-methyl-N-(4-methylphenyl)piperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-N-(3-methylphenyl)piperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-N-(4-methylphenyl)piperazine-1-carboxamide;2-methyl-N-(3-methylphenyl)-4-[3-(trifluoromethyl)-2-pyridinyl]piperazine-1-carboxamide;2-methyl-N-(4-methylphenyl)-4-[3-(trifluoromethyl)-2-pyridinyl]piperazine-1-carboxamide;N-(4-methylphenyl)-4-[3-(trifluoromethyl)-2-pyridinyl]piperazine-1-carboxamide (CID 161078256) is 4-(3-chloro-2-pyridinyl)-2-methyl-N-(3-methylphenyl)piperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-2-methyl-N-(4-methylphenyl)piperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-N-(3-methylphenyl)piperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-N-(4-methylphenyl)piperazine-1-carboxamide;2-methyl-N-(3-methylphenyl)-4-[3-(trifluoromethyl)-2-pyridinyl]piperazine-1-carboxamide;2-methyl-N-(4-methylphenyl)-4-[3-(trifluoromethyl)-2-pyridinyl]piperazine-1-carboxamide;N-(4-methylphenyl)-4-[3-(trifluoromethyl)-2-pyridinyl]piperazine-1-carboxamide.
What is the SMILES notation for 4-(3-chloro-2-pyridinyl)-2-methyl-N-(3-methylphenyl)piperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-2-methyl-N-(4-methylphenyl)piperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-N-(3-methylphenyl)piperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-N-(4-methylphenyl)piperazine-1-carboxamide;2-methyl-N-(3-methylphenyl)-4-[3-(trifluoromethyl)-2-pyridinyl]piperazine-1-carboxamide;2-methyl-N-(4-methylphenyl)-4-[3-(trifluoromethyl)-2-pyridinyl]piperazine-1-carboxamide;N-(4-methylphenyl)-4-[3-(trifluoromethyl)-2-pyridinyl]piperazine-1-carboxamide?
The canonical SMILES for 4-(3-chloro-2-pyridinyl)-2-methyl-N-(3-methylphenyl)piperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-2-methyl-N-(4-methylphenyl)piperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-N-(3-methylphenyl)piperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-N-(4-methylphenyl)piperazine-1-carboxamide;2-methyl-N-(3-methylphenyl)-4-[3-(trifluoromethyl)-2-pyridinyl]piperazine-1-carboxamide;2-methyl-N-(4-methylphenyl)-4-[3-(trifluoromethyl)-2-pyridinyl]piperazine-1-carboxamide;N-(4-methylphenyl)-4-[3-(trifluoromethyl)-2-pyridinyl]piperazine-1-carboxamide is Cc1ccc(NC(=O)N2CCN(c3ncccc3C(F)(F)F)CC2)cc1.Cc1ccc(NC(=O)N2CCN(c3ncccc3C(F)(F)F)CC2C)cc1.Cc1ccc(NC(=O)N2CCN(c3ncccc3Cl)CC2)cc1.Cc1ccc(NC(=O)N2CCN(c3ncccc3Cl)CC2C)cc1.Cc1cccc(NC(=O)N2CCN(c3ncccc3C(F)(F)F)CC2C)c1.Cc1cccc(NC(=O)N2CCN(c3ncccc3Cl)CC2)c1.Cc1cccc(NC(=O)N2CCN(c3ncccc3Cl)CC2C)c1.
What is the InChIKey of 4-(3-chloro-2-pyridinyl)-2-methyl-N-(3-methylphenyl)piperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-2-methyl-N-(4-methylphenyl)piperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-N-(3-methylphenyl)piperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-N-(4-methylphenyl)piperazine-1-carboxamide;2-methyl-N-(3-methylphenyl)-4-[3-(trifluoromethyl)-2-pyridinyl]piperazine-1-carboxamide;2-methyl-N-(4-methylphenyl)-4-[3-(trifluoromethyl)-2-pyridinyl]piperazine-1-carboxamide;N-(4-methylphenyl)-4-[3-(trifluoromethyl)-2-pyridinyl]piperazine-1-carboxamide?
The InChIKey is UFOLFCKQHNQOEU-UHFFFAOYSA-N. The full InChI is InChI=1S/2C19H21F3N4O.2C18H21ClN4O.C18H19F3N4O.2C17H19ClN4O/c1-13-5-3-6-15(11-13)24-18(27)26-10-9-25(12-14(26)2)17-16(19(20,21)22)7-4-8-23-17;1-13-5-7-15(8-6-13)24-18(27)26-11-10-25(12-14(26)2)17-16(19(20,21)22)4-3-9-23-17;1-13-5-3-6-15(11-13)21-18(24)23-10-9-22(12-14(23)2)17-16(19)7-4-8-20-17;1-13-5-7-15(8-6-13)21-18(24)23-11-10-22(12-14(23)2)17-16(19)4-3-9-20-17;1-13-4-6-14(7-5-13)23-17(26)25-11-9-24(10-12-25)16-15(18(19,20)21)3-2-8-22-16;1-13-4-2-5-14(12-13)20-17(23)22-10-8-21(9-11-22)16-15(18)6-3-7-19-16;1-13-4-6-14(7-5-13)20-17(23)22-11-9-21(10-12-22)16-15(18)3-2-8-19-16/h3-8,11,14H,9-10,12H2,1-2H3,(H,24,27);3-9,14H,10-12H2,1-2H3,(H,24,27);3-8,11,14H,9-10,12H2,1-2H3,(H,21,24);3-9,14H,10-12H2,1-2H3,(H,21,24);2-8H,9-12H2,1H3,(H,23,26);2-7,12H,8-11H2,1H3,(H,20,23);2-8H,9-12H2,1H3,(H,20,23).
What are the key properties of 4-(3-chloro-2-pyridinyl)-2-methyl-N-(3-methylphenyl)piperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-2-methyl-N-(4-methylphenyl)piperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-N-(3-methylphenyl)piperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-N-(4-methylphenyl)piperazine-1-carboxamide;2-methyl-N-(3-methylphenyl)-4-[3-(trifluoromethyl)-2-pyridinyl]piperazine-1-carboxamide;2-methyl-N-(4-methylphenyl)-4-[3-(trifluoromethyl)-2-pyridinyl]piperazine-1-carboxamide;N-(4-methylphenyl)-4-[3-(trifluoromethyl)-2-pyridinyl]piperazine-1-carboxamide?
4-(3-chloro-2-pyridinyl)-2-methyl-N-(3-methylphenyl)piperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-2-methyl-N-(4-methylphenyl)piperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-N-(3-methylphenyl)piperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-N-(4-methylphenyl)piperazine-1-carboxamide;2-methyl-N-(3-methylphenyl)-4-[3-(trifluoromethyl)-2-pyridinyl]piperazine-1-carboxamide;2-methyl-N-(4-methylphenyl)-4-[3-(trifluoromethyl)-2-pyridinyl]piperazine-1-carboxamide;N-(4-methylphenyl)-4-[3-(trifluoromethyl)-2-pyridinyl]piperazine-1-carboxamide has a molecular weight of 2472.50 g/mol, XLogP of 26.43, 14 rotatable bonds, 7 hydrogen bond donors, and 21 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-chloro-2-pyridinyl)-2-methyl-N-(3-methylphenyl)piperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-2-methyl-N-(4-methylphenyl)piperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-N-(3-methylphenyl)piperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-N-(4-methylphenyl)piperazine-1-carboxamide;2-methyl-N-(3-methylphenyl)-4-[3-(trifluoromethyl)-2-pyridinyl]piperazine-1-carboxamide;2-methyl-N-(4-methylphenyl)-4-[3-(trifluoromethyl)-2-pyridinyl]piperazine-1-carboxamide;N-(4-methylphenyl)-4-[3-(trifluoromethyl)-2-pyridinyl]piperazine-1-carboxamide is sourced from PubChem (CID 161078256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).