N,N-dimethyl-4-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]pyridine-2-carboxamide;N,N-dimethyl-5-(1-phenyl-3-propan-2-ylpyrazol-5-yl)thiophene-2-carboxamide;N,N-dimethyl-5-(3-propan-2-yl-1-propylpyrazol-5-yl)thiophene-2-carboxamide;N,N-dimethyl-5-(5-propan-2-yl-1-propylpyrazol-3-yl)thiophene-2-carboxamide;N,N-dimethyl-5-(5-propan-2-yl-1H-pyrazol-3-yl)thiophene-2-carboxamide;5-(1,5-dimethylpyrazol-3-yl)-N,N-dimethylthiophene-2-carboxamide;5-[1-(2-hydroxyethyl)-3-propan-2-ylpyrazol-5-yl]-N,N-dimethylthiophene-2-carboxamide

C104H133F3N22O8S6 — CID 160720069

IUPACN,N-dimethyl-4-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]pyridine-2-carboxamide;N,N-dimethyl-5-(1-phenyl-3-propan-2-ylpyrazol-5-yl)thiophene-2-carboxamide;N,N-dimethyl-5-(3-propan-2-yl-1-propylpyrazol-5-yl)thiophene-2-carboxamide;N,N-dimethyl-5-(5-propan-2-yl-1-propylpyrazol-3-yl)thiophene-2-carboxamide;N,N-dimethyl-5-(5-propan-2-yl-1H-pyrazol-3-yl)thiophene-2-carboxamide;5-(1,5-dimethylpyrazol-3-yl)-N,N-dimethylthiophene-2-carboxamide;5-[1-(2-hydroxyethyl)-3-propan-2-ylpyrazol-5-yl]-N,N-dimethylthiophene-2-carboxamide
SMILESCC(C)c1cc(-c2ccc(C(=O)N(C)C)s2)n(-c2ccccc2)n1.CC(C)c1cc(-c2ccc(C(=O)N(C)C)s2)n(CCO)n1.CC(C)c1cc(-c2ccc(C(=O)N(C)C)s2)n[nH]1.CCCn1nc(-c2ccc(C(=O)N(C)C)s2)cc1C(C)C.CCCn1nc(C(C)C)cc1-c1ccc(C(=O)N(C)C)s1.CN(C)C(=O)c1cc(-c2cc(C(F)(F)F)n(C)n2)ccn1.Cc1cc(-c2ccc(C(=O)N(C)C)s2)nn1C
InChIInChI=1S/C19H21N3OS.2C16H23N3OS.C15H21N3O2S.C13H13F3N4O.C13H17N3OS.C12H15N3OS/c1-13(2)15-12-16(22(20-15)14-8-6-5-7-9-14)17-10-11-18(24-17)19(23)21(3)4;1-6-9-19-13(11(2)3)10-12(17-19)14-7-8-15(21-14)16(20)18(4)5;1-6-9-19-13(10-12(17-19)11(2)3)14-7-8-15(21-14)16(20)18(4)5;1-10(2)11-9-12(18(16-11)7-8-19)13-5-6-14(21-13)15(20)17(3)4;1-19(2)12(21)10-6-8(4-5-17-10)9-7-11(13(14,15)16)20(3)18-9;1-8(2)9-7-10(15-14-9)11-5-6-12(18-11)13(17)16(3)4;1-8-7-9(13-15(8)4)10-5-6-11(17-10)12(16)14(2)3/h5-13H,1-4H3;2*7-8,10-11H,6,9H2,1-5H3;5-6,9-10,19H,7-8H2,1-4H3;4-7H,1-3H3;5-8H,1-4H3,(H,14,15);5-7H,1-4H3
InChIKeyRSZHFWJMECMNII-UHFFFAOYSA-N
MW2068.75 g/mol
LogP21.87
Rot. Bonds26

About N,N-dimethyl-4-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]pyridine-2-carboxamide;N,N-dimethyl-5-(1-phenyl-3-propan-2-ylpyrazol-5-yl)thiophene-2-carboxamide;N,N-dimethyl-5-(3-propan-2-yl-1-propylpyrazol-5-yl)thiophene-2-carboxamide;N,N-dimethyl-5-(5-propan-2-yl-1-propylpyrazol-3-yl)thiophene-2-carboxamide;N,N-dimethyl-5-(5-propan-2-yl-1H-pyrazol-3-yl)thiophene-2-carboxamide;5-(1,5-dimethylpyrazol-3-yl)-N,N-dimethylthiophene-2-carboxamide;5-[1-(2-hydroxyethyl)-3-propan-2-ylpyrazol-5-yl]-N,N-dimethylthiophene-2-carboxamide

N,N-dimethyl-4-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]pyridine-2-carboxamide;N,N-dimethyl-5-(1-phenyl-3-propan-2-ylpyrazol-5-yl)thiophene-2-carboxamide;N,N-dimethyl-5-(3-propan-2-yl-1-propylpyrazol-5-yl)thiophene-2-carboxamide;N,N-dimethyl-5-(5-propan-2-yl-1-propylpyrazol-3-yl)thiophene-2-carboxamide;N,N-dimethyl-5-(5-propan-2-yl-1H-pyrazol-3-yl)thiophene-2-carboxamide;5-(1,5-dimethylpyrazol-3-yl)-N,N-dimethylthiophene-2-carboxamide;5-[1-(2-hydroxyethyl)-3-propan-2-ylpyrazol-5-yl]-N,N-dimethylthiophene-2-carboxamide (PubChem CID 160720069) has the molecular formula C104H133F3N22O8S6 and a molecular weight of 2068.75 g/mol. Its IUPAC name is N,N-dimethyl-4-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]pyridine-2-carboxamide;N,N-dimethyl-5-(1-phenyl-3-propan-2-ylpyrazol-5-yl)thiophene-2-carboxamide;N,N-dimethyl-5-(3-propan-2-yl-1-propylpyrazol-5-yl)thiophene-2-carboxamide;N,N-dimethyl-5-(5-propan-2-yl-1-propylpyrazol-3-yl)thiophene-2-carboxamide;N,N-dimethyl-5-(5-propan-2-yl-1H-pyrazol-3-yl)thiophene-2-carboxamide;5-(1,5-dimethylpyrazol-3-yl)-N,N-dimethylthiophene-2-carboxamide;5-[1-(2-hydroxyethyl)-3-propan-2-ylpyrazol-5-yl]-N,N-dimethylthiophene-2-carboxamide.

Molecular Properties

Compound NameN,N-dimethyl-4-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]pyridine-2-carboxamide;N,N-dimethyl-5-(1-phenyl-3-propan-2-ylpyrazol-5-yl)thiophene-2-carboxamide;N,N-dimethyl-5-(3-propan-2-yl-1-propylpyrazol-5-yl)thiophene-2-carboxamide;N,N-dimethyl-5-(5-propan-2-yl-1-propylpyrazol-3-yl)thiophene-2-carboxamide;N,N-dimethyl-5-(5-propan-2-yl-1H-pyrazol-3-yl)thiophene-2-carboxamide;5-(1,5-dimethylpyrazol-3-yl)-N,N-dimethylthiophene-2-carboxamide;5-[1-(2-hydroxyethyl)-3-propan-2-ylpyrazol-5-yl]-N,N-dimethylthiophene-2-carboxamide
PubChem CID160720069
Molecular FormulaC104H133F3N22O8S6
Molecular Weight2068.75 g/mol
Exact Mass2066.90
IUPAC NameN,N-dimethyl-4-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]pyridine-2-carboxamide;N,N-dimethyl-5-(1-phenyl-3-propan-2-ylpyrazol-5-yl)thiophene-2-carboxamide;N,N-dimethyl-5-(3-propan-2-yl-1-propylpyrazol-5-yl)thiophene-2-carboxamide;N,N-dimethyl-5-(5-propan-2-yl-1-propylpyrazol-3-yl)thiophene-2-carboxamide;N,N-dimethyl-5-(5-propan-2-yl-1H-pyrazol-3-yl)thiophene-2-carboxamide;5-(1,5-dimethylpyrazol-3-yl)-N,N-dimethylthiophene-2-carboxamide;5-[1-(2-hydroxyethyl)-3-propan-2-ylpyrazol-5-yl]-N,N-dimethylthiophene-2-carboxamide
SMILESCC(C)c1cc(-c2ccc(C(=O)N(C)C)s2)n(-c2ccccc2)n1.CC(C)c1cc(-c2ccc(C(=O)N(C)C)s2)n(CCO)n1.CC(C)c1cc(-c2ccc(C(=O)N(C)C)s2)n[nH]1.CCCn1nc(-c2ccc(C(=O)N(C)C)s2)cc1C(C)C.CCCn1nc(C(C)C)cc1-c1ccc(C(=O)N(C)C)s1.CN(C)C(=O)c1cc(-c2cc(C(F)(F)F)n(C)n2)ccn1.Cc1cc(-c2ccc(C(=O)N(C)C)s2)nn1C
InChIInChI=1S/C19H21N3OS.2C16H23N3OS.C15H21N3O2S.C13H13F3N4O.C13H17N3OS.C12H15N3OS/c1-13(2)15-12-16(22(20-15)14-8-6-5-7-9-14)17-10-11-18(24-17)19(23)21(3)4;1-6-9-19-13(11(2)3)10-12(17-19)14-7-8-15(21-14)16(20)18(4)5;1-6-9-19-13(10-12(17-19)11(2)3)14-7-8-15(21-14)16(20)18(4)5;1-10(2)11-9-12(18(16-11)7-8-19)13-5-6-14(21-13)15(20)17(3)4;1-19(2)12(21)10-6-8(4-5-17-10)9-7-11(13(14,15)16)20(3)18-9;1-8(2)9-7-10(15-14-9)11-5-6-12(18-11)13(17)16(3)4;1-8-7-9(13-15(8)4)10-5-6-11(17-10)12(16)14(2)3/h5-13H,1-4H3;2*7-8,10-11H,6,9H2,1-5H3;5-6,9-10,19H,7-8H2,1-4H3;4-7H,1-3H3;5-8H,1-4H3,(H,14,15);5-7H,1-4H3
InChIKeyRSZHFWJMECMNII-UHFFFAOYSA-N
XLogP21.87
TPSA310.89 Ų
H-Bond Donors2
H-Bond Acceptors28
Rotatable Bonds26
Heavy Atoms143
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002068.75
LogP ≤ 521.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1028

Analyze N,N-dimethyl-4-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]pyridine-2-carboxamide;N,N-dimethyl-5-(1-phenyl-3-propan-2-ylpyrazol-5-yl)thiophene-2-carboxamide;N,N-dimethyl-5-(3-propan-2-yl-1-propylpyrazol-5-yl)thiophene-2-carboxamide;N,N-dimethyl-5-(5-propan-2-yl-1-propylpyrazol-3-yl)thiophene-2-carboxamide;N,N-dimethyl-5-(5-propan-2-yl-1H-pyrazol-3-yl)thiophene-2-carboxamide;5-(1,5-dimethylpyrazol-3-yl)-N,N-dimethylthiophene-2-carboxamide;5-[1-(2-hydroxyethyl)-3-propan-2-ylpyrazol-5-yl]-N,N-dimethylthiophene-2-carboxamide with MolForge

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-4-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]pyridine-2-carboxamide;N,N-dimethyl-5-(1-phenyl-3-propan-2-ylpyrazol-5-yl)thiophene-2-carboxamide;N,N-dimethyl-5-(3-propan-2-yl-1-propylpyrazol-5-yl)thiophene-2-carboxamide;N,N-dimethyl-5-(5-propan-2-yl-1-propylpyrazol-3-yl)thiophene-2-carboxamide;N,N-dimethyl-5-(5-propan-2-yl-1H-pyrazol-3-yl)thiophene-2-carboxamide;5-(1,5-dimethylpyrazol-3-yl)-N,N-dimethylthiophene-2-carboxamide;5-[1-(2-hydroxyethyl)-3-propan-2-ylpyrazol-5-yl]-N,N-dimethylthiophene-2-carboxamide?
The IUPAC name of N,N-dimethyl-4-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]pyridine-2-carboxamide;N,N-dimethyl-5-(1-phenyl-3-propan-2-ylpyrazol-5-yl)thiophene-2-carboxamide;N,N-dimethyl-5-(3-propan-2-yl-1-propylpyrazol-5-yl)thiophene-2-carboxamide;N,N-dimethyl-5-(5-propan-2-yl-1-propylpyrazol-3-yl)thiophene-2-carboxamide;N,N-dimethyl-5-(5-propan-2-yl-1H-pyrazol-3-yl)thiophene-2-carboxamide;5-(1,5-dimethylpyrazol-3-yl)-N,N-dimethylthiophene-2-carboxamide;5-[1-(2-hydroxyethyl)-3-propan-2-ylpyrazol-5-yl]-N,N-dimethylthiophene-2-carboxamide (CID 160720069) is N,N-dimethyl-4-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]pyridine-2-carboxamide;N,N-dimethyl-5-(1-phenyl-3-propan-2-ylpyrazol-5-yl)thiophene-2-carboxamide;N,N-dimethyl-5-(3-propan-2-yl-1-propylpyrazol-5-yl)thiophene-2-carboxamide;N,N-dimethyl-5-(5-propan-2-yl-1-propylpyrazol-3-yl)thiophene-2-carboxamide;N,N-dimethyl-5-(5-propan-2-yl-1H-pyrazol-3-yl)thiophene-2-carboxamide;5-(1,5-dimethylpyrazol-3-yl)-N,N-dimethylthiophene-2-carboxamide;5-[1-(2-hydroxyethyl)-3-propan-2-ylpyrazol-5-yl]-N,N-dimethylthiophene-2-carboxamide.
What is the SMILES notation for N,N-dimethyl-4-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]pyridine-2-carboxamide;N,N-dimethyl-5-(1-phenyl-3-propan-2-ylpyrazol-5-yl)thiophene-2-carboxamide;N,N-dimethyl-5-(3-propan-2-yl-1-propylpyrazol-5-yl)thiophene-2-carboxamide;N,N-dimethyl-5-(5-propan-2-yl-1-propylpyrazol-3-yl)thiophene-2-carboxamide;N,N-dimethyl-5-(5-propan-2-yl-1H-pyrazol-3-yl)thiophene-2-carboxamide;5-(1,5-dimethylpyrazol-3-yl)-N,N-dimethylthiophene-2-carboxamide;5-[1-(2-hydroxyethyl)-3-propan-2-ylpyrazol-5-yl]-N,N-dimethylthiophene-2-carboxamide?
The canonical SMILES for N,N-dimethyl-4-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]pyridine-2-carboxamide;N,N-dimethyl-5-(1-phenyl-3-propan-2-ylpyrazol-5-yl)thiophene-2-carboxamide;N,N-dimethyl-5-(3-propan-2-yl-1-propylpyrazol-5-yl)thiophene-2-carboxamide;N,N-dimethyl-5-(5-propan-2-yl-1-propylpyrazol-3-yl)thiophene-2-carboxamide;N,N-dimethyl-5-(5-propan-2-yl-1H-pyrazol-3-yl)thiophene-2-carboxamide;5-(1,5-dimethylpyrazol-3-yl)-N,N-dimethylthiophene-2-carboxamide;5-[1-(2-hydroxyethyl)-3-propan-2-ylpyrazol-5-yl]-N,N-dimethylthiophene-2-carboxamide is CC(C)c1cc(-c2ccc(C(=O)N(C)C)s2)n(-c2ccccc2)n1.CC(C)c1cc(-c2ccc(C(=O)N(C)C)s2)n(CCO)n1.CC(C)c1cc(-c2ccc(C(=O)N(C)C)s2)n[nH]1.CCCn1nc(-c2ccc(C(=O)N(C)C)s2)cc1C(C)C.CCCn1nc(C(C)C)cc1-c1ccc(C(=O)N(C)C)s1.CN(C)C(=O)c1cc(-c2cc(C(F)(F)F)n(C)n2)ccn1.Cc1cc(-c2ccc(C(=O)N(C)C)s2)nn1C.
What is the InChIKey of N,N-dimethyl-4-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]pyridine-2-carboxamide;N,N-dimethyl-5-(1-phenyl-3-propan-2-ylpyrazol-5-yl)thiophene-2-carboxamide;N,N-dimethyl-5-(3-propan-2-yl-1-propylpyrazol-5-yl)thiophene-2-carboxamide;N,N-dimethyl-5-(5-propan-2-yl-1-propylpyrazol-3-yl)thiophene-2-carboxamide;N,N-dimethyl-5-(5-propan-2-yl-1H-pyrazol-3-yl)thiophene-2-carboxamide;5-(1,5-dimethylpyrazol-3-yl)-N,N-dimethylthiophene-2-carboxamide;5-[1-(2-hydroxyethyl)-3-propan-2-ylpyrazol-5-yl]-N,N-dimethylthiophene-2-carboxamide?
The InChIKey is RSZHFWJMECMNII-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N3OS.2C16H23N3OS.C15H21N3O2S.C13H13F3N4O.C13H17N3OS.C12H15N3OS/c1-13(2)15-12-16(22(20-15)14-8-6-5-7-9-14)17-10-11-18(24-17)19(23)21(3)4;1-6-9-19-13(11(2)3)10-12(17-19)14-7-8-15(21-14)16(20)18(4)5;1-6-9-19-13(10-12(17-19)11(2)3)14-7-8-15(21-14)16(20)18(4)5;1-10(2)11-9-12(18(16-11)7-8-19)13-5-6-14(21-13)15(20)17(3)4;1-19(2)12(21)10-6-8(4-5-17-10)9-7-11(13(14,15)16)20(3)18-9;1-8(2)9-7-10(15-14-9)11-5-6-12(18-11)13(17)16(3)4;1-8-7-9(13-15(8)4)10-5-6-11(17-10)12(16)14(2)3/h5-13H,1-4H3;2*7-8,10-11H,6,9H2,1-5H3;5-6,9-10,19H,7-8H2,1-4H3;4-7H,1-3H3;5-8H,1-4H3,(H,14,15);5-7H,1-4H3.
What are the key properties of N,N-dimethyl-4-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]pyridine-2-carboxamide;N,N-dimethyl-5-(1-phenyl-3-propan-2-ylpyrazol-5-yl)thiophene-2-carboxamide;N,N-dimethyl-5-(3-propan-2-yl-1-propylpyrazol-5-yl)thiophene-2-carboxamide;N,N-dimethyl-5-(5-propan-2-yl-1-propylpyrazol-3-yl)thiophene-2-carboxamide;N,N-dimethyl-5-(5-propan-2-yl-1H-pyrazol-3-yl)thiophene-2-carboxamide;5-(1,5-dimethylpyrazol-3-yl)-N,N-dimethylthiophene-2-carboxamide;5-[1-(2-hydroxyethyl)-3-propan-2-ylpyrazol-5-yl]-N,N-dimethylthiophene-2-carboxamide?
N,N-dimethyl-4-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]pyridine-2-carboxamide;N,N-dimethyl-5-(1-phenyl-3-propan-2-ylpyrazol-5-yl)thiophene-2-carboxamide;N,N-dimethyl-5-(3-propan-2-yl-1-propylpyrazol-5-yl)thiophene-2-carboxamide;N,N-dimethyl-5-(5-propan-2-yl-1-propylpyrazol-3-yl)thiophene-2-carboxamide;N,N-dimethyl-5-(5-propan-2-yl-1H-pyrazol-3-yl)thiophene-2-carboxamide;5-(1,5-dimethylpyrazol-3-yl)-N,N-dimethylthiophene-2-carboxamide;5-[1-(2-hydroxyethyl)-3-propan-2-ylpyrazol-5-yl]-N,N-dimethylthiophene-2-carboxamide has a molecular weight of 2068.75 g/mol, XLogP of 21.87, 26 rotatable bonds, 2 hydrogen bond donors, and 28 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-4-[1-methyl-5-(trifluoromethyl)pyrazol-3-yl]pyridine-2-carboxamide;N,N-dimethyl-5-(1-phenyl-3-propan-2-ylpyrazol-5-yl)thiophene-2-carboxamide;N,N-dimethyl-5-(3-propan-2-yl-1-propylpyrazol-5-yl)thiophene-2-carboxamide;N,N-dimethyl-5-(5-propan-2-yl-1-propylpyrazol-3-yl)thiophene-2-carboxamide;N,N-dimethyl-5-(5-propan-2-yl-1H-pyrazol-3-yl)thiophene-2-carboxamide;5-(1,5-dimethylpyrazol-3-yl)-N,N-dimethylthiophene-2-carboxamide;5-[1-(2-hydroxyethyl)-3-propan-2-ylpyrazol-5-yl]-N,N-dimethylthiophene-2-carboxamide is sourced from PubChem (CID 160720069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).