6-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)-N-[4-(trifluoromethoxy)phenyl]pyrazin-2-amine

C20H16F3N5O — CID 118094600

IUPAC6-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)-N-[4-(trifluoromethoxy)phenyl]pyrazin-2-amine
SMILESCCc1nn2ccccc2c1-c1cncc(Nc2ccc(OC(F)(F)F)cc2)n1
InChIInChI=1S/C20H16F3N5O/c1-2-15-19(17-5-3-4-10-28(17)27-15)16-11-24-12-18(26-16)25-13-6-8-14(9-7-13)29-20(21,22)23/h3-12H,2H2,1H3,(H,25,26)
InChIKeyXGLYUHJNJXKAGL-UHFFFAOYSA-N
MW399.38 g/mol
LogP5.00
Rot. Bonds5

About 6-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)-N-[4-(trifluoromethoxy)phenyl]pyrazin-2-amine

6-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)-N-[4-(trifluoromethoxy)phenyl]pyrazin-2-amine (PubChem CID 118094600) has the molecular formula C20H16F3N5O and a molecular weight of 399.38 g/mol. Its IUPAC name is 6-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)-N-[4-(trifluoromethoxy)phenyl]pyrazin-2-amine.

Molecular Properties

Compound Name6-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)-N-[4-(trifluoromethoxy)phenyl]pyrazin-2-amine
PubChem CID118094600
Molecular FormulaC20H16F3N5O
Molecular Weight399.38 g/mol
Exact Mass399.13
IUPAC Name6-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)-N-[4-(trifluoromethoxy)phenyl]pyrazin-2-amine
SMILESCCc1nn2ccccc2c1-c1cncc(Nc2ccc(OC(F)(F)F)cc2)n1
InChIInChI=1S/C20H16F3N5O/c1-2-15-19(17-5-3-4-10-28(17)27-15)16-11-24-12-18(26-16)25-13-6-8-14(9-7-13)29-20(21,22)23/h3-12H,2H2,1H3,(H,25,26)
InChIKeyXGLYUHJNJXKAGL-UHFFFAOYSA-N
XLogP5.00
TPSA64.34 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500399.38
LogP ≤ 55.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(4-methylphenyl)-6-(2-methylpyrazolo[1,5-a]pyridin-3-yl)pyrazin-2-amine
CID 118094743
6-[1-ethyl-5-methyl-3-(trifluoromethyl)pyrazol-4-yl]-N-[4-(trifluoromethoxy)phenyl]pyrazin-2-amine
CID 118101423
6-N-ethyl-2-N-[4-(trifluoromethoxy)phenyl]pyrazine-2,6-diamine
CID 80768969
N-(4-chlorophenyl)-6-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)pyrazin-2-amine;2-N-(4-chlorophenyl)-6-(2-methylbenzimidazol-1-yl)pyridine-2,4-diamine;6-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)-N-(4-fluorophenyl)pyrazin-2-amine;6-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)-N-(4-methylphenyl)pyrazin-2-amine;6-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)-N-phenylpyrazin-2-amine;6-(2-methylbenzimidazol-1-yl)-2-N-(4-methylphenyl)pyridine-2,4-diamine
CID 158012117
2-[4-(difluoromethoxy)-3-fluoroanilino]-6-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)pyridine-4-carbonitrile
CID 118095141
N-(4-methoxyphenyl)-6-[2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrazin-2-amine
CID 91799361
N-[4-(trifluoromethoxy)phenyl]-6-[2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyridin-2-amine
CID 118101462
N-[4-(difluoromethoxy)phenyl]-6-(1-ethyl-3,5-dimethylpyrazol-4-yl)pyrazin-2-amine
CID 118094470
3-ethyl-1-methyl-5-N-[4-(trifluoromethoxy)phenyl]pyrazole-4,5-diamine
CID 66015577
4-(trifluoromethoxy)-N-[4-(trifluoromethoxy)phenyl]aniline
CID 87491792
2-ethyl-N-[[4-[[4-(trifluoromethoxy)phenyl]methylamino]phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide;methane
CID 161026096
6-(2-cyclopropylimidazo[1,2-a]pyridin-3-yl)-N-[4-(difluoromethoxy)phenyl]pyrazin-2-amine
CID 118094943

Frequently Asked Questions

What is the IUPAC name of 6-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)-N-[4-(trifluoromethoxy)phenyl]pyrazin-2-amine?
The IUPAC name of 6-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)-N-[4-(trifluoromethoxy)phenyl]pyrazin-2-amine (CID 118094600) is 6-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)-N-[4-(trifluoromethoxy)phenyl]pyrazin-2-amine.
What is the SMILES notation for 6-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)-N-[4-(trifluoromethoxy)phenyl]pyrazin-2-amine?
The canonical SMILES for 6-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)-N-[4-(trifluoromethoxy)phenyl]pyrazin-2-amine is CCc1nn2ccccc2c1-c1cncc(Nc2ccc(OC(F)(F)F)cc2)n1.
What is the InChIKey of 6-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)-N-[4-(trifluoromethoxy)phenyl]pyrazin-2-amine?
The InChIKey is XGLYUHJNJXKAGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16F3N5O/c1-2-15-19(17-5-3-4-10-28(17)27-15)16-11-24-12-18(26-16)25-13-6-8-14(9-7-13)29-20(21,22)23/h3-12H,2H2,1H3,(H,25,26).
What are the key properties of 6-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)-N-[4-(trifluoromethoxy)phenyl]pyrazin-2-amine?
6-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)-N-[4-(trifluoromethoxy)phenyl]pyrazin-2-amine has a molecular weight of 399.38 g/mol, XLogP of 5.00, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)-N-[4-(trifluoromethoxy)phenyl]pyrazin-2-amine is sourced from PubChem (CID 118094600), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).