N-[6-(difluoromethyl)-1H-indazol-5-yl]-6-(2-fluoropropan-2-yl)pyridine-2-carboxamide

C17H15F3N4O — CID 155448654

IUPACN-[6-(difluoromethyl)-1H-indazol-5-yl]-6-(2-fluoropropan-2-yl)pyridine-2-carboxamide
SMILESCC(C)(F)c1cccc(C(=O)Nc2cc3cn[nH]c3cc2C(F)F)n1
InChIInChI=1S/C17H15F3N4O/c1-17(2,20)14-5-3-4-11(22-14)16(25)23-13-6-9-8-21-24-12(9)7-10(13)15(18)19/h3-8,15H,1-2H3,(H,21,24)(H,23,25)
InChIKeyCEWJGNLSSZJCAQ-UHFFFAOYSA-N
MW348.33 g/mol
LogP4.35
Rot. Bonds4

About N-[6-(difluoromethyl)-1H-indazol-5-yl]-6-(2-fluoropropan-2-yl)pyridine-2-carboxamide

N-[6-(difluoromethyl)-1H-indazol-5-yl]-6-(2-fluoropropan-2-yl)pyridine-2-carboxamide (PubChem CID 155448654) has the molecular formula C17H15F3N4O and a molecular weight of 348.33 g/mol. Its IUPAC name is N-[6-(difluoromethyl)-1H-indazol-5-yl]-6-(2-fluoropropan-2-yl)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[6-(difluoromethyl)-1H-indazol-5-yl]-6-(2-fluoropropan-2-yl)pyridine-2-carboxamide
PubChem CID155448654
Molecular FormulaC17H15F3N4O
Molecular Weight348.33 g/mol
Exact Mass348.12
IUPAC NameN-[6-(difluoromethyl)-1H-indazol-5-yl]-6-(2-fluoropropan-2-yl)pyridine-2-carboxamide
SMILESCC(C)(F)c1cccc(C(=O)Nc2cc3cn[nH]c3cc2C(F)F)n1
InChIInChI=1S/C17H15F3N4O/c1-17(2,20)14-5-3-4-11(22-14)16(25)23-13-6-9-8-21-24-12(9)7-10(13)15(18)19/h3-8,15H,1-2H3,(H,21,24)(H,23,25)
InChIKeyCEWJGNLSSZJCAQ-UHFFFAOYSA-N
XLogP4.35
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.33
LogP ≤ 54.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

6-(1,1-difluoroethyl)-N-[6-(2-hydroxypropan-2-yl)-1H-indazol-5-yl]pyridine-2-carboxamide
CID 164801989
N-(6-cyclopropyl-1H-indazol-5-yl)-6-(trifluoromethyl)pyridine-2-carboxamide
CID 164568086
6-(difluoromethyl)-N-methyl-1H-indazol-5-amine
CID 155751931
2-(6-chloro-1H-indazol-5-yl)-1-[6-(trifluoromethyl)-2-pyridinyl]ethanone
CID 158850062
N-[6-(difluoromethyl)-2-[3-(iodomethyl)cyclobutyl]indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide
CID 167156433
6-tert-butyl-N-[5-(1,3-thiazol-2-yl)-1H-pyrazol-4-yl]pyridine-2-carboxamide
CID 154867895
N-[2-[3-[[tert-butyl(diphenyl)silyl]oxymethyl]cyclobutyl]-6-(difluoromethyl)indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide
CID 164567131
2,6-dimethoxy-N-(5-methyl-1H-indazol-6-yl)benzamide
CID 154835907
N-(6-methoxy-1H-indazol-5-yl)-2-(trifluoromethyl)pyridine-4-carboxamide
CID 167375608
N-[6-(2-hydroxypropan-2-yl)-2-methylindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide
CID 138727771
tert-butyl N-(6-bromo-1H-indazol-5-yl)carbamate
CID 118182563
N-[6-(2-hydroxypropan-2-yl)-2-piperidin-4-ylindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide
CID 137377537

Frequently Asked Questions

What is the IUPAC name of N-[6-(difluoromethyl)-1H-indazol-5-yl]-6-(2-fluoropropan-2-yl)pyridine-2-carboxamide?
The IUPAC name of N-[6-(difluoromethyl)-1H-indazol-5-yl]-6-(2-fluoropropan-2-yl)pyridine-2-carboxamide (CID 155448654) is N-[6-(difluoromethyl)-1H-indazol-5-yl]-6-(2-fluoropropan-2-yl)pyridine-2-carboxamide.
What is the SMILES notation for N-[6-(difluoromethyl)-1H-indazol-5-yl]-6-(2-fluoropropan-2-yl)pyridine-2-carboxamide?
The canonical SMILES for N-[6-(difluoromethyl)-1H-indazol-5-yl]-6-(2-fluoropropan-2-yl)pyridine-2-carboxamide is CC(C)(F)c1cccc(C(=O)Nc2cc3cn[nH]c3cc2C(F)F)n1.
What is the InChIKey of N-[6-(difluoromethyl)-1H-indazol-5-yl]-6-(2-fluoropropan-2-yl)pyridine-2-carboxamide?
The InChIKey is CEWJGNLSSZJCAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15F3N4O/c1-17(2,20)14-5-3-4-11(22-14)16(25)23-13-6-9-8-21-24-12(9)7-10(13)15(18)19/h3-8,15H,1-2H3,(H,21,24)(H,23,25).
What are the key properties of N-[6-(difluoromethyl)-1H-indazol-5-yl]-6-(2-fluoropropan-2-yl)pyridine-2-carboxamide?
N-[6-(difluoromethyl)-1H-indazol-5-yl]-6-(2-fluoropropan-2-yl)pyridine-2-carboxamide has a molecular weight of 348.33 g/mol, XLogP of 4.35, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(difluoromethyl)-1H-indazol-5-yl]-6-(2-fluoropropan-2-yl)pyridine-2-carboxamide is sourced from PubChem (CID 155448654), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).