4-[1-cyclopentyl-3-(trifluoromethyl)pyrazol-5-yl]-N,N-dimethylbenzamide;N,N-dimethyl-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]benzamide;N,N-dimethyl-4-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]benzamide;N,N-dimethyl-4-[1-(2,2,2-trifluoroethyl)-3-(trifluoromethyl)pyrazol-5-yl]benzamide;4-[1-ethyl-3-(trifluoromethyl)pyrazol-5-yl]-N,N-dimethylbenzamide;4-[1-ethyl-5-(trifluoromethyl)pyrazol-3-yl]-N,N-dimethylbenzamide;4-[1-(2-hydroxyethyl)-3-(trifluoromethyl)pyrazol-5-yl]-N,N-dimethylbenzamide

C106H109F24N21O8 — CID 157150051

IUPAC4-[1-cyclopentyl-3-(trifluoromethyl)pyrazol-5-yl]-N,N-dimethylbenzamide;N,N-dimethyl-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]benzamide;N,N-dimethyl-4-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]benzamide;N,N-dimethyl-4-[1-(2,2,2-trifluoroethyl)-3-(trifluoromethyl)pyrazol-5-yl]benzamide;4-[1-ethyl-3-(trifluoromethyl)pyrazol-5-yl]-N,N-dimethylbenzamide;4-[1-ethyl-5-(trifluoromethyl)pyrazol-3-yl]-N,N-dimethylbenzamide;4-[1-(2-hydroxyethyl)-3-(trifluoromethyl)pyrazol-5-yl]-N,N-dimethylbenzamide
SMILESCCn1nc(-c2ccc(C(=O)N(C)C)cc2)cc1C(F)(F)F.CCn1nc(C(F)(F)F)cc1-c1ccc(C(=O)N(C)C)cc1.CN(C)C(=O)c1ccc(-c2cc(C(F)(F)F)n(C)n2)cc1.CN(C)C(=O)c1ccc(-c2cc(C(F)(F)F)nn2C)cc1.CN(C)C(=O)c1ccc(-c2cc(C(F)(F)F)nn2C2CCCC2)cc1.CN(C)C(=O)c1ccc(-c2cc(C(F)(F)F)nn2CC(F)(F)F)cc1.CN(C)C(=O)c1ccc(-c2cc(C(F)(F)F)nn2CCO)cc1
InChIInChI=1S/C18H20F3N3O.C15H13F6N3O.C15H16F3N3O2.2C15H16F3N3O.2C14H14F3N3O/c1-23(2)17(25)13-9-7-12(8-10-13)15-11-16(18(19,20)21)22-24(15)14-5-3-4-6-14;1-23(2)13(25)10-5-3-9(4-6-10)11-7-12(15(19,20)21)22-24(11)8-14(16,17)18;1-20(2)14(23)11-5-3-10(4-6-11)12-9-13(15(16,17)18)19-21(12)7-8-22;1-4-21-12(9-13(19-21)15(16,17)18)10-5-7-11(8-6-10)14(22)20(2)3;1-4-21-13(15(16,17)18)9-12(19-21)10-5-7-11(8-6-10)14(22)20(2)3;1-19(2)13(21)10-6-4-9(5-7-10)11-8-12(14(15,16)17)18-20(11)3;1-19(2)13(21)10-6-4-9(5-7-10)11-8-12(14(15,16)17)20(3)18-11/h7-11,14H,3-6H2,1-2H3;3-7H,8H2,1-2H3;3-6,9,22H,7-8H2,1-2H3;2*5-9H,4H2,1-3H3;2*4-8H,1-3H3
InChIKeyALDPMOQFXWUGMS-UHFFFAOYSA-N
MW2261.13 g/mol
LogP22.68
Rot. Bonds20

About 4-[1-cyclopentyl-3-(trifluoromethyl)pyrazol-5-yl]-N,N-dimethylbenzamide;N,N-dimethyl-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]benzamide;N,N-dimethyl-4-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]benzamide;N,N-dimethyl-4-[1-(2,2,2-trifluoroethyl)-3-(trifluoromethyl)pyrazol-5-yl]benzamide;4-[1-ethyl-3-(trifluoromethyl)pyrazol-5-yl]-N,N-dimethylbenzamide;4-[1-ethyl-5-(trifluoromethyl)pyrazol-3-yl]-N,N-dimethylbenzamide;4-[1-(2-hydroxyethyl)-3-(trifluoromethyl)pyrazol-5-yl]-N,N-dimethylbenzamide

4-[1-cyclopentyl-3-(trifluoromethyl)pyrazol-5-yl]-N,N-dimethylbenzamide;N,N-dimethyl-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]benzamide;N,N-dimethyl-4-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]benzamide;N,N-dimethyl-4-[1-(2,2,2-trifluoroethyl)-3-(trifluoromethyl)pyrazol-5-yl]benzamide;4-[1-ethyl-3-(trifluoromethyl)pyrazol-5-yl]-N,N-dimethylbenzamide;4-[1-ethyl-5-(trifluoromethyl)pyrazol-3-yl]-N,N-dimethylbenzamide;4-[1-(2-hydroxyethyl)-3-(trifluoromethyl)pyrazol-5-yl]-N,N-dimethylbenzamide (PubChem CID 157150051) has the molecular formula C106H109F24N21O8 and a molecular weight of 2261.13 g/mol. Its IUPAC name is 4-[1-cyclopentyl-3-(trifluoromethyl)pyrazol-5-yl]-N,N-dimethylbenzamide;N,N-dimethyl-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]benzamide;N,N-dimethyl-4-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]benzamide;N,N-dimethyl-4-[1-(2,2,2-trifluoroethyl)-3-(trifluoromethyl)pyrazol-5-yl]benzamide;4-[1-ethyl-3-(trifluoromethyl)pyrazol-5-yl]-N,N-dimethylbenzamide;4-[1-ethyl-5-(trifluoromethyl)pyrazol-3-yl]-N,N-dimethylbenzamide;4-[1-(2-hydroxyethyl)-3-(trifluoromethyl)pyrazol-5-yl]-N,N-dimethylbenzamide.

Molecular Properties

Compound Name4-[1-cyclopentyl-3-(trifluoromethyl)pyrazol-5-yl]-N,N-dimethylbenzamide;N,N-dimethyl-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]benzamide;N,N-dimethyl-4-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]benzamide;N,N-dimethyl-4-[1-(2,2,2-trifluoroethyl)-3-(trifluoromethyl)pyrazol-5-yl]benzamide;4-[1-ethyl-3-(trifluoromethyl)pyrazol-5-yl]-N,N-dimethylbenzamide;4-[1-ethyl-5-(trifluoromethyl)pyrazol-3-yl]-N,N-dimethylbenzamide;4-[1-(2-hydroxyethyl)-3-(trifluoromethyl)pyrazol-5-yl]-N,N-dimethylbenzamide
PubChem CID157150051
Molecular FormulaC106H109F24N21O8
Molecular Weight2261.13 g/mol
Exact Mass2259.84
IUPAC Name4-[1-cyclopentyl-3-(trifluoromethyl)pyrazol-5-yl]-N,N-dimethylbenzamide;N,N-dimethyl-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]benzamide;N,N-dimethyl-4-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]benzamide;N,N-dimethyl-4-[1-(2,2,2-trifluoroethyl)-3-(trifluoromethyl)pyrazol-5-yl]benzamide;4-[1-ethyl-3-(trifluoromethyl)pyrazol-5-yl]-N,N-dimethylbenzamide;4-[1-ethyl-5-(trifluoromethyl)pyrazol-3-yl]-N,N-dimethylbenzamide;4-[1-(2-hydroxyethyl)-3-(trifluoromethyl)pyrazol-5-yl]-N,N-dimethylbenzamide
SMILESCCn1nc(-c2ccc(C(=O)N(C)C)cc2)cc1C(F)(F)F.CCn1nc(C(F)(F)F)cc1-c1ccc(C(=O)N(C)C)cc1.CN(C)C(=O)c1ccc(-c2cc(C(F)(F)F)n(C)n2)cc1.CN(C)C(=O)c1ccc(-c2cc(C(F)(F)F)nn2C)cc1.CN(C)C(=O)c1ccc(-c2cc(C(F)(F)F)nn2C2CCCC2)cc1.CN(C)C(=O)c1ccc(-c2cc(C(F)(F)F)nn2CC(F)(F)F)cc1.CN(C)C(=O)c1ccc(-c2cc(C(F)(F)F)nn2CCO)cc1
InChIInChI=1S/C18H20F3N3O.C15H13F6N3O.C15H16F3N3O2.2C15H16F3N3O.2C14H14F3N3O/c1-23(2)17(25)13-9-7-12(8-10-13)15-11-16(18(19,20)21)22-24(15)14-5-3-4-6-14;1-23(2)13(25)10-5-3-9(4-6-10)11-7-12(15(19,20)21)22-24(11)8-14(16,17)18;1-20(2)14(23)11-5-3-10(4-6-11)12-9-13(15(16,17)18)19-21(12)7-8-22;1-4-21-12(9-13(19-21)15(16,17)18)10-5-7-11(8-6-10)14(22)20(2)3;1-4-21-13(15(16,17)18)9-12(19-21)10-5-7-11(8-6-10)14(22)20(2)3;1-19(2)13(21)10-6-4-9(5-7-10)11-8-12(14(15,16)17)18-20(11)3;1-19(2)13(21)10-6-4-9(5-7-10)11-8-12(14(15,16)17)20(3)18-11/h7-11,14H,3-6H2,1-2H3;3-7H,8H2,1-2H3;3-6,9,22H,7-8H2,1-2H3;2*5-9H,4H2,1-3H3;2*4-8H,1-3H3
InChIKeyALDPMOQFXWUGMS-UHFFFAOYSA-N
XLogP22.68
TPSA287.14 Ų
H-Bond Donors1
H-Bond Acceptors22
Rotatable Bonds20
Heavy Atoms159
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002261.13
LogP ≤ 522.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1022

Analyze 4-[1-cyclopentyl-3-(trifluoromethyl)pyrazol-5-yl]-N,N-dimethylbenzamide;N,N-dimethyl-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]benzamide;N,N-dimethyl-4-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]benzamide;N,N-dimethyl-4-[1-(2,2,2-trifluoroethyl)-3-(trifluoromethyl)pyrazol-5-yl]benzamide;4-[1-ethyl-3-(trifluoromethyl)pyrazol-5-yl]-N,N-dimethylbenzamide;4-[1-ethyl-5-(trifluoromethyl)pyrazol-3-yl]-N,N-dimethylbenzamide;4-[1-(2-hydroxyethyl)-3-(trifluoromethyl)pyrazol-5-yl]-N,N-dimethylbenzamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 4-[1-cyclopentyl-3-(trifluoromethyl)pyrazol-5-yl]-N,N-dimethylbenzamide;N,N-dimethyl-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]benzamide;N,N-dimethyl-4-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]benzamide;N,N-dimethyl-4-[1-(2,2,2-trifluoroethyl)-3-(trifluoromethyl)pyrazol-5-yl]benzamide;4-[1-ethyl-3-(trifluoromethyl)pyrazol-5-yl]-N,N-dimethylbenzamide;4-[1-ethyl-5-(trifluoromethyl)pyrazol-3-yl]-N,N-dimethylbenzamide;4-[1-(2-hydroxyethyl)-3-(trifluoromethyl)pyrazol-5-yl]-N,N-dimethylbenzamide?
The IUPAC name of 4-[1-cyclopentyl-3-(trifluoromethyl)pyrazol-5-yl]-N,N-dimethylbenzamide;N,N-dimethyl-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]benzamide;N,N-dimethyl-4-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]benzamide;N,N-dimethyl-4-[1-(2,2,2-trifluoroethyl)-3-(trifluoromethyl)pyrazol-5-yl]benzamide;4-[1-ethyl-3-(trifluoromethyl)pyrazol-5-yl]-N,N-dimethylbenzamide;4-[1-ethyl-5-(trifluoromethyl)pyrazol-3-yl]-N,N-dimethylbenzamide;4-[1-(2-hydroxyethyl)-3-(trifluoromethyl)pyrazol-5-yl]-N,N-dimethylbenzamide (CID 157150051) is 4-[1-cyclopentyl-3-(trifluoromethyl)pyrazol-5-yl]-N,N-dimethylbenzamide;N,N-dimethyl-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]benzamide;N,N-dimethyl-4-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]benzamide;N,N-dimethyl-4-[1-(2,2,2-trifluoroethyl)-3-(trifluoromethyl)pyrazol-5-yl]benzamide;4-[1-ethyl-3-(trifluoromethyl)pyrazol-5-yl]-N,N-dimethylbenzamide;4-[1-ethyl-5-(trifluoromethyl)pyrazol-3-yl]-N,N-dimethylbenzamide;4-[1-(2-hydroxyethyl)-3-(trifluoromethyl)pyrazol-5-yl]-N,N-dimethylbenzamide.
What is the SMILES notation for 4-[1-cyclopentyl-3-(trifluoromethyl)pyrazol-5-yl]-N,N-dimethylbenzamide;N,N-dimethyl-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]benzamide;N,N-dimethyl-4-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]benzamide;N,N-dimethyl-4-[1-(2,2,2-trifluoroethyl)-3-(trifluoromethyl)pyrazol-5-yl]benzamide;4-[1-ethyl-3-(trifluoromethyl)pyrazol-5-yl]-N,N-dimethylbenzamide;4-[1-ethyl-5-(trifluoromethyl)pyrazol-3-yl]-N,N-dimethylbenzamide;4-[1-(2-hydroxyethyl)-3-(trifluoromethyl)pyrazol-5-yl]-N,N-dimethylbenzamide?
The canonical SMILES for 4-[1-cyclopentyl-3-(trifluoromethyl)pyrazol-5-yl]-N,N-dimethylbenzamide;N,N-dimethyl-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]benzamide;N,N-dimethyl-4-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]benzamide;N,N-dimethyl-4-[1-(2,2,2-trifluoroethyl)-3-(trifluoromethyl)pyrazol-5-yl]benzamide;4-[1-ethyl-3-(trifluoromethyl)pyrazol-5-yl]-N,N-dimethylbenzamide;4-[1-ethyl-5-(trifluoromethyl)pyrazol-3-yl]-N,N-dimethylbenzamide;4-[1-(2-hydroxyethyl)-3-(trifluoromethyl)pyrazol-5-yl]-N,N-dimethylbenzamide is CCn1nc(-c2ccc(C(=O)N(C)C)cc2)cc1C(F)(F)F.CCn1nc(C(F)(F)F)cc1-c1ccc(C(=O)N(C)C)cc1.CN(C)C(=O)c1ccc(-c2cc(C(F)(F)F)n(C)n2)cc1.CN(C)C(=O)c1ccc(-c2cc(C(F)(F)F)nn2C)cc1.CN(C)C(=O)c1ccc(-c2cc(C(F)(F)F)nn2C2CCCC2)cc1.CN(C)C(=O)c1ccc(-c2cc(C(F)(F)F)nn2CC(F)(F)F)cc1.CN(C)C(=O)c1ccc(-c2cc(C(F)(F)F)nn2CCO)cc1.
What is the InChIKey of 4-[1-cyclopentyl-3-(trifluoromethyl)pyrazol-5-yl]-N,N-dimethylbenzamide;N,N-dimethyl-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]benzamide;N,N-dimethyl-4-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]benzamide;N,N-dimethyl-4-[1-(2,2,2-trifluoroethyl)-3-(trifluoromethyl)pyrazol-5-yl]benzamide;4-[1-ethyl-3-(trifluoromethyl)pyrazol-5-yl]-N,N-dimethylbenzamide;4-[1-ethyl-5-(trifluoromethyl)pyrazol-3-yl]-N,N-dimethylbenzamide;4-[1-(2-hydroxyethyl)-3-(trifluoromethyl)pyrazol-5-yl]-N,N-dimethylbenzamide?
The InChIKey is ALDPMOQFXWUGMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20F3N3O.C15H13F6N3O.C15H16F3N3O2.2C15H16F3N3O.2C14H14F3N3O/c1-23(2)17(25)13-9-7-12(8-10-13)15-11-16(18(19,20)21)22-24(15)14-5-3-4-6-14;1-23(2)13(25)10-5-3-9(4-6-10)11-7-12(15(19,20)21)22-24(11)8-14(16,17)18;1-20(2)14(23)11-5-3-10(4-6-11)12-9-13(15(16,17)18)19-21(12)7-8-22;1-4-21-12(9-13(19-21)15(16,17)18)10-5-7-11(8-6-10)14(22)20(2)3;1-4-21-13(15(16,17)18)9-12(19-21)10-5-7-11(8-6-10)14(22)20(2)3;1-19(2)13(21)10-6-4-9(5-7-10)11-8-12(14(15,16)17)18-20(11)3;1-19(2)13(21)10-6-4-9(5-7-10)11-8-12(14(15,16)17)20(3)18-11/h7-11,14H,3-6H2,1-2H3;3-7H,8H2,1-2H3;3-6,9,22H,7-8H2,1-2H3;2*5-9H,4H2,1-3H3;2*4-8H,1-3H3.
What are the key properties of 4-[1-cyclopentyl-3-(trifluoromethyl)pyrazol-5-yl]-N,N-dimethylbenzamide;N,N-dimethyl-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]benzamide;N,N-dimethyl-4-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]benzamide;N,N-dimethyl-4-[1-(2,2,2-trifluoroethyl)-3-(trifluoromethyl)pyrazol-5-yl]benzamide;4-[1-ethyl-3-(trifluoromethyl)pyrazol-5-yl]-N,N-dimethylbenzamide;4-[1-ethyl-5-(trifluoromethyl)pyrazol-3-yl]-N,N-dimethylbenzamide;4-[1-(2-hydroxyethyl)-3-(trifluoromethyl)pyrazol-5-yl]-N,N-dimethylbenzamide?
4-[1-cyclopentyl-3-(trifluoromethyl)pyrazol-5-yl]-N,N-dimethylbenzamide;N,N-dimethyl-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]benzamide;N,N-dimethyl-4-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]benzamide;N,N-dimethyl-4-[1-(2,2,2-trifluoroethyl)-3-(trifluoromethyl)pyrazol-5-yl]benzamide;4-[1-ethyl-3-(trifluoromethyl)pyrazol-5-yl]-N,N-dimethylbenzamide;4-[1-ethyl-5-(trifluoromethyl)pyrazol-3-yl]-N,N-dimethylbenzamide;4-[1-(2-hydroxyethyl)-3-(trifluoromethyl)pyrazol-5-yl]-N,N-dimethylbenzamide has a molecular weight of 2261.13 g/mol, XLogP of 22.68, 20 rotatable bonds, 1 hydrogen bond donors, and 22 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-cyclopentyl-3-(trifluoromethyl)pyrazol-5-yl]-N,N-dimethylbenzamide;N,N-dimethyl-4-[1-methyl-3-(trifluoromethyl)pyrazol-5-yl]benzamide;N,N-dimethyl-4-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]benzamide;N,N-dimethyl-4-[1-(2,2,2-trifluoroethyl)-3-(trifluoromethyl)pyrazol-5-yl]benzamide;4-[1-ethyl-3-(trifluoromethyl)pyrazol-5-yl]-N,N-dimethylbenzamide;4-[1-ethyl-5-(trifluoromethyl)pyrazol-3-yl]-N,N-dimethylbenzamide;4-[1-(2-hydroxyethyl)-3-(trifluoromethyl)pyrazol-5-yl]-N,N-dimethylbenzamide is sourced from PubChem (CID 157150051), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).