5-pyridin-3-yl-1-[4-(trifluoromethyl)-3-pyridinyl]indazole-3-carboxamide

C19H12F3N5O — CID 142719718

IUPAC5-pyridin-3-yl-1-[4-(trifluoromethyl)-3-pyridinyl]indazole-3-carboxamide
SMILESNC(=O)c1nn(-c2cnccc2C(F)(F)F)c2ccc(-c3cccnc3)cc12
InChIInChI=1S/C19H12F3N5O/c20-19(21,22)14-5-7-25-10-16(14)27-15-4-3-11(12-2-1-6-24-9-12)8-13(15)17(26-27)18(23)28/h1-10H,(H2,23,28)
InChIKeyCHKSWNYDCWMLHL-UHFFFAOYSA-N
MW383.33 g/mol
LogP3.60
Rot. Bonds3

About 5-pyridin-3-yl-1-[4-(trifluoromethyl)-3-pyridinyl]indazole-3-carboxamide

5-pyridin-3-yl-1-[4-(trifluoromethyl)-3-pyridinyl]indazole-3-carboxamide (PubChem CID 142719718) has the molecular formula C19H12F3N5O and a molecular weight of 383.33 g/mol. Its IUPAC name is 5-pyridin-3-yl-1-[4-(trifluoromethyl)-3-pyridinyl]indazole-3-carboxamide.

Molecular Properties

Compound Name5-pyridin-3-yl-1-[4-(trifluoromethyl)-3-pyridinyl]indazole-3-carboxamide
PubChem CID142719718
Molecular FormulaC19H12F3N5O
Molecular Weight383.33 g/mol
Exact Mass383.10
IUPAC Name5-pyridin-3-yl-1-[4-(trifluoromethyl)-3-pyridinyl]indazole-3-carboxamide
SMILESNC(=O)c1nn(-c2cnccc2C(F)(F)F)c2ccc(-c3cccnc3)cc12
InChIInChI=1S/C19H12F3N5O/c20-19(21,22)14-5-7-25-10-16(14)27-15-4-3-11(12-2-1-6-24-9-12)8-13(15)17(26-27)18(23)28/h1-10H,(H2,23,28)
InChIKeyCHKSWNYDCWMLHL-UHFFFAOYSA-N
XLogP3.60
TPSA86.69 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.33
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-[4-(dimethylamino)cyclohexyl]-5-pyridin-3-ylindazole-3-carboxamide
CID 140689312
2-(3-acetyl-5-pyridin-3-ylindazol-1-yl)acetic acid
CID 126623066
9-[2,3-bis(3,6-diphenylcarbazol-9-yl)-5-[4-pyridin-3-yl-3,5-bis(trifluoromethyl)phenyl]phenyl]-3,6-diphenylcarbazole
CID 138700405
1,3-dipyridin-3-ylindazole-5-carboxamide
CID 174835120
3-pyridin-3-ylbenzamide;hydrochloride
CID 175813431
N-(1-amino-3,3-dimethyl-1-oxobutan-2-yl)-1-benzyl-5-pyridin-3-ylindazole-3-carboxamide
CID 70969181
1-[2-(dimethylamino)ethylcarbamoyl]-5-pyridin-3-ylindazole-3-carboxylic acid
CID 174835202
5-pyridin-3-yl-1-(2-pyrrolidin-1-ylethylcarbamoyl)indazole-3-carboxylic acid
CID 174835132
1-(oxan-2-yl)-5-pyridin-3-ylindazole-3-carboxylic acid
CID 86679701
ethyl 5-pyridin-3-yl-3-(trifluoromethyl)pyridine-2-carboxylate
CID 46317787
3-[4-methoxy-3-(trifluoromethyl)phenyl]pyridine
CID 46317327
3-[3-(chloromethyl)-4-(trifluoromethyl)phenyl]pyridine
CID 46316213

Frequently Asked Questions

What is the IUPAC name of 5-pyridin-3-yl-1-[4-(trifluoromethyl)-3-pyridinyl]indazole-3-carboxamide?
The IUPAC name of 5-pyridin-3-yl-1-[4-(trifluoromethyl)-3-pyridinyl]indazole-3-carboxamide (CID 142719718) is 5-pyridin-3-yl-1-[4-(trifluoromethyl)-3-pyridinyl]indazole-3-carboxamide.
What is the SMILES notation for 5-pyridin-3-yl-1-[4-(trifluoromethyl)-3-pyridinyl]indazole-3-carboxamide?
The canonical SMILES for 5-pyridin-3-yl-1-[4-(trifluoromethyl)-3-pyridinyl]indazole-3-carboxamide is NC(=O)c1nn(-c2cnccc2C(F)(F)F)c2ccc(-c3cccnc3)cc12.
What is the InChIKey of 5-pyridin-3-yl-1-[4-(trifluoromethyl)-3-pyridinyl]indazole-3-carboxamide?
The InChIKey is CHKSWNYDCWMLHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H12F3N5O/c20-19(21,22)14-5-7-25-10-16(14)27-15-4-3-11(12-2-1-6-24-9-12)8-13(15)17(26-27)18(23)28/h1-10H,(H2,23,28).
What are the key properties of 5-pyridin-3-yl-1-[4-(trifluoromethyl)-3-pyridinyl]indazole-3-carboxamide?
5-pyridin-3-yl-1-[4-(trifluoromethyl)-3-pyridinyl]indazole-3-carboxamide has a molecular weight of 383.33 g/mol, XLogP of 3.60, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-pyridin-3-yl-1-[4-(trifluoromethyl)-3-pyridinyl]indazole-3-carboxamide is sourced from PubChem (CID 142719718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).