N-[6-amino-5-[2-(trifluoromethoxy)phenyl]-2-pyridinyl]-3-methyl-1-(2-trimethylsilylethoxymethyl)pyrazole-4-carboxamide;N-[6-amino-5-[2-(trifluoromethoxy)phenyl]-2-pyridinyl]-5-methyl-1-(2-trimethylsilylethoxymethyl)pyrazole-4-carboxamide

C46H56F6N10O6Si2 — CID 158511699

IUPACN-[6-amino-5-[2-(trifluoromethoxy)phenyl]-2-pyridinyl]-3-methyl-1-(2-trimethylsilylethoxymethyl)pyrazole-4-carboxamide;N-[6-amino-5-[2-(trifluoromethoxy)phenyl]-2-pyridinyl]-5-methyl-1-(2-trimethylsilylethoxymethyl)pyrazole-4-carboxamide
SMILESCc1c(C(=O)Nc2ccc(-c3ccccc3OC(F)(F)F)c(N)n2)cnn1COCC[Si](C)(C)C.Cc1nn(COCC[Si](C)(C)C)cc1C(=O)Nc1ccc(-c2ccccc2OC(F)(F)F)c(N)n1
InChIInChI=1S/2C23H28F3N5O3Si/c1-15-18(13-31(30-15)14-33-11-12-35(2,3)4)22(32)29-20-10-9-17(21(27)28-20)16-7-5-6-8-19(16)34-23(24,25)26;1-15-18(13-28-31(15)14-33-11-12-35(2,3)4)22(32)30-20-10-9-17(21(27)29-20)16-7-5-6-8-19(16)34-23(24,25)26/h5-10,13H,11-12,14H2,1-4H3,(H3,27,28,29,32);5-10,13H,11-12,14H2,1-4H3,(H3,27,29,30,32)
InChIKeyHLDFOVVGKAKUON-UHFFFAOYSA-N
MW1015.18 g/mol
LogP10.60
Rot. Bonds18

About N-[6-amino-5-[2-(trifluoromethoxy)phenyl]-2-pyridinyl]-3-methyl-1-(2-trimethylsilylethoxymethyl)pyrazole-4-carboxamide;N-[6-amino-5-[2-(trifluoromethoxy)phenyl]-2-pyridinyl]-5-methyl-1-(2-trimethylsilylethoxymethyl)pyrazole-4-carboxamide

N-[6-amino-5-[2-(trifluoromethoxy)phenyl]-2-pyridinyl]-3-methyl-1-(2-trimethylsilylethoxymethyl)pyrazole-4-carboxamide;N-[6-amino-5-[2-(trifluoromethoxy)phenyl]-2-pyridinyl]-5-methyl-1-(2-trimethylsilylethoxymethyl)pyrazole-4-carboxamide (PubChem CID 158511699) has the molecular formula C46H56F6N10O6Si2 and a molecular weight of 1015.18 g/mol. Its IUPAC name is N-[6-amino-5-[2-(trifluoromethoxy)phenyl]-2-pyridinyl]-3-methyl-1-(2-trimethylsilylethoxymethyl)pyrazole-4-carboxamide;N-[6-amino-5-[2-(trifluoromethoxy)phenyl]-2-pyridinyl]-5-methyl-1-(2-trimethylsilylethoxymethyl)pyrazole-4-carboxamide.

Molecular Properties

Compound NameN-[6-amino-5-[2-(trifluoromethoxy)phenyl]-2-pyridinyl]-3-methyl-1-(2-trimethylsilylethoxymethyl)pyrazole-4-carboxamide;N-[6-amino-5-[2-(trifluoromethoxy)phenyl]-2-pyridinyl]-5-methyl-1-(2-trimethylsilylethoxymethyl)pyrazole-4-carboxamide
PubChem CID158511699
Molecular FormulaC46H56F6N10O6Si2
Molecular Weight1015.18 g/mol
Exact Mass1014.38
IUPAC NameN-[6-amino-5-[2-(trifluoromethoxy)phenyl]-2-pyridinyl]-3-methyl-1-(2-trimethylsilylethoxymethyl)pyrazole-4-carboxamide;N-[6-amino-5-[2-(trifluoromethoxy)phenyl]-2-pyridinyl]-5-methyl-1-(2-trimethylsilylethoxymethyl)pyrazole-4-carboxamide
SMILESCc1c(C(=O)Nc2ccc(-c3ccccc3OC(F)(F)F)c(N)n2)cnn1COCC[Si](C)(C)C.Cc1nn(COCC[Si](C)(C)C)cc1C(=O)Nc1ccc(-c2ccccc2OC(F)(F)F)c(N)n1
InChIInChI=1S/2C23H28F3N5O3Si/c1-15-18(13-31(30-15)14-33-11-12-35(2,3)4)22(32)29-20-10-9-17(21(27)28-20)16-7-5-6-8-19(16)34-23(24,25)26;1-15-18(13-28-31(15)14-33-11-12-35(2,3)4)22(32)30-20-10-9-17(21(27)29-20)16-7-5-6-8-19(16)34-23(24,25)26/h5-10,13H,11-12,14H2,1-4H3,(H3,27,28,29,32);5-10,13H,11-12,14H2,1-4H3,(H3,27,29,30,32)
InChIKeyHLDFOVVGKAKUON-UHFFFAOYSA-N
XLogP10.60
TPSA208.58 Ų
H-Bond Donors4
H-Bond Acceptors14
Rotatable Bonds18
Heavy Atoms70
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001015.18
LogP ≤ 510.60
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1014

Computed Properties (RDKit)

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

Analyze N-[6-amino-5-[2-(trifluoromethoxy)phenyl]-2-pyridinyl]-3-methyl-1-(2-trimethylsilylethoxymethyl)pyrazole-4-carboxamide;N-[6-amino-5-[2-(trifluoromethoxy)phenyl]-2-pyridinyl]-5-methyl-1-(2-trimethylsilylethoxymethyl)pyrazole-4-carboxamide with MolForge

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Related Compounds

5-fluoro-N-(5-(2-methoxy-5-(1-methyl-1H-pyrazol-4-yl)phenyl)pyrazin-2-yl)-4-methylnicotinamide
CID 70977988
5-fluoro-4-methyl-N-(5-(5-(1-methyl-1H-pyrazol-4-yl)-2-(trifluoromethoxy)phenyl)pyrazin-2-yl)nicotinamide
CID 71010061
US10364238, Example 126
CID 121365050
1-[4-(2-methoxyphenyl)-2-pyrimidinyl]-5-methyl-N-[2,2,2-trifluoro-1-(3-pyridinyl)ethyl]-1H-pyrazole-4-carboxamide
CID 45167155
6-[3-pyridin-3-yl-5-(trifluoromethyl)pyrazol-1-yl]-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide
CID 17748356
N-{6-amino-5-[2-(trifluoromethoxy)phenyl]pyridin-2-yl}-3-methyl-1-{[2-(trimethylsilyl)ethoxy]methyl}-1H-pyrazole-4-carboxamide
CID 57582317
N-[6-amino-5-[2-(trifluoromethoxy)phenyl]pyridin-2-yl]-5-methyl-1-(2-trimethylsilylethoxymethyl)pyrazole-4-carboxamide
CID 57582319
N-{6-Amino-5-[2-(trifluoromethoxy)phenyl]pyridin-2-yl}-3-methyl-1H-pyrazole-4-carboxamide
CID 57582325
1-[6-[2-[[4-[1-(2,2,2-Trifluoroethyl)piperidin-4-yl]phenyl]methoxy]phenyl]pyridin-2-yl]-5-(trifluoromethyl)pyrazole-4-carboxamide
CID 59452003
N-[[6-amino-5-[2-(trifluoromethoxy)phenyl]-2-pyridinyl]methyl]-1-(2-trimethylsilylethoxymethyl)pyrazole-4-carboxamide
CID 66637005
N-[6-(4-hydroxy-4-phenylpiperidin-1-yl)pyridin-3-yl]-1-(4-methoxyphenyl)-5-(trifluoromethyl)pyrazole-4-carboxamide
CID 68245587
N-[4-[2-[4-(hydroxymethyl)phenoxy]pyrimidin-5-yl]phenyl]-1-pyridin-2-yl-3-(trifluoromethyl)pyrazole-4-carboxamide
CID 68331389

Frequently Asked Questions

What is the IUPAC name of N-[6-amino-5-[2-(trifluoromethoxy)phenyl]-2-pyridinyl]-3-methyl-1-(2-trimethylsilylethoxymethyl)pyrazole-4-carboxamide;N-[6-amino-5-[2-(trifluoromethoxy)phenyl]-2-pyridinyl]-5-methyl-1-(2-trimethylsilylethoxymethyl)pyrazole-4-carboxamide?
The IUPAC name of N-[6-amino-5-[2-(trifluoromethoxy)phenyl]-2-pyridinyl]-3-methyl-1-(2-trimethylsilylethoxymethyl)pyrazole-4-carboxamide;N-[6-amino-5-[2-(trifluoromethoxy)phenyl]-2-pyridinyl]-5-methyl-1-(2-trimethylsilylethoxymethyl)pyrazole-4-carboxamide (CID 158511699) is N-[6-amino-5-[2-(trifluoromethoxy)phenyl]-2-pyridinyl]-3-methyl-1-(2-trimethylsilylethoxymethyl)pyrazole-4-carboxamide;N-[6-amino-5-[2-(trifluoromethoxy)phenyl]-2-pyridinyl]-5-methyl-1-(2-trimethylsilylethoxymethyl)pyrazole-4-carboxamide.
What is the SMILES notation for N-[6-amino-5-[2-(trifluoromethoxy)phenyl]-2-pyridinyl]-3-methyl-1-(2-trimethylsilylethoxymethyl)pyrazole-4-carboxamide;N-[6-amino-5-[2-(trifluoromethoxy)phenyl]-2-pyridinyl]-5-methyl-1-(2-trimethylsilylethoxymethyl)pyrazole-4-carboxamide?
The canonical SMILES for N-[6-amino-5-[2-(trifluoromethoxy)phenyl]-2-pyridinyl]-3-methyl-1-(2-trimethylsilylethoxymethyl)pyrazole-4-carboxamide;N-[6-amino-5-[2-(trifluoromethoxy)phenyl]-2-pyridinyl]-5-methyl-1-(2-trimethylsilylethoxymethyl)pyrazole-4-carboxamide is Cc1c(C(=O)Nc2ccc(-c3ccccc3OC(F)(F)F)c(N)n2)cnn1COCC[Si](C)(C)C.Cc1nn(COCC[Si](C)(C)C)cc1C(=O)Nc1ccc(-c2ccccc2OC(F)(F)F)c(N)n1.
What is the InChIKey of N-[6-amino-5-[2-(trifluoromethoxy)phenyl]-2-pyridinyl]-3-methyl-1-(2-trimethylsilylethoxymethyl)pyrazole-4-carboxamide;N-[6-amino-5-[2-(trifluoromethoxy)phenyl]-2-pyridinyl]-5-methyl-1-(2-trimethylsilylethoxymethyl)pyrazole-4-carboxamide?
The InChIKey is HLDFOVVGKAKUON-UHFFFAOYSA-N. The full InChI is InChI=1S/2C23H28F3N5O3Si/c1-15-18(13-31(30-15)14-33-11-12-35(2,3)4)22(32)29-20-10-9-17(21(27)28-20)16-7-5-6-8-19(16)34-23(24,25)26;1-15-18(13-28-31(15)14-33-11-12-35(2,3)4)22(32)30-20-10-9-17(21(27)29-20)16-7-5-6-8-19(16)34-23(24,25)26/h5-10,13H,11-12,14H2,1-4H3,(H3,27,28,29,32);5-10,13H,11-12,14H2,1-4H3,(H3,27,29,30,32).
What are the key properties of N-[6-amino-5-[2-(trifluoromethoxy)phenyl]-2-pyridinyl]-3-methyl-1-(2-trimethylsilylethoxymethyl)pyrazole-4-carboxamide;N-[6-amino-5-[2-(trifluoromethoxy)phenyl]-2-pyridinyl]-5-methyl-1-(2-trimethylsilylethoxymethyl)pyrazole-4-carboxamide?
N-[6-amino-5-[2-(trifluoromethoxy)phenyl]-2-pyridinyl]-3-methyl-1-(2-trimethylsilylethoxymethyl)pyrazole-4-carboxamide;N-[6-amino-5-[2-(trifluoromethoxy)phenyl]-2-pyridinyl]-5-methyl-1-(2-trimethylsilylethoxymethyl)pyrazole-4-carboxamide has a molecular weight of 1015.18 g/mol, XLogP of 10.60, 18 rotatable bonds, 4 hydrogen bond donors, and 14 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-amino-5-[2-(trifluoromethoxy)phenyl]-2-pyridinyl]-3-methyl-1-(2-trimethylsilylethoxymethyl)pyrazole-4-carboxamide;N-[6-amino-5-[2-(trifluoromethoxy)phenyl]-2-pyridinyl]-5-methyl-1-(2-trimethylsilylethoxymethyl)pyrazole-4-carboxamide is sourced from PubChem (CID 158511699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).