N-(5-methyl-2-pyridinyl)-3,5-bis(trifluoromethyl)benzamide

C15H10F6N2O — CID 43016681

IUPACN-(5-methyl-2-pyridinyl)-3,5-bis(trifluoromethyl)benzamide
SMILESCc1ccc(NC(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)nc1
InChIInChI=1S/C15H10F6N2O/c1-8-2-3-12(22-7-8)23-13(24)9-4-10(14(16,17)18)6-11(5-9)15(19,20)21/h2-7H,1H3,(H,22,23,24)
InChIKeyBXIZRXMMONGWET-UHFFFAOYSA-N
MW348.25 g/mol
LogP4.68
Rot. Bonds2

About N-(5-methyl-2-pyridinyl)-3,5-bis(trifluoromethyl)benzamide

N-(5-methyl-2-pyridinyl)-3,5-bis(trifluoromethyl)benzamide (PubChem CID 43016681) has the molecular formula C15H10F6N2O and a molecular weight of 348.25 g/mol. Its IUPAC name is N-(5-methyl-2-pyridinyl)-3,5-bis(trifluoromethyl)benzamide.

Molecular Properties

Compound NameN-(5-methyl-2-pyridinyl)-3,5-bis(trifluoromethyl)benzamide
PubChem CID43016681
Molecular FormulaC15H10F6N2O
Molecular Weight348.25 g/mol
Exact Mass348.07
IUPAC NameN-(5-methyl-2-pyridinyl)-3,5-bis(trifluoromethyl)benzamide
SMILESCc1ccc(NC(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)nc1
InChIInChI=1S/C15H10F6N2O/c1-8-2-3-12(22-7-8)23-13(24)9-4-10(14(16,17)18)6-11(5-9)15(19,20)21/h2-7H,1H3,(H,22,23,24)
InChIKeyBXIZRXMMONGWET-UHFFFAOYSA-N
XLogP4.68
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.25
LogP ≤ 54.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3,5-dibromo-N-(5-methyl-2-pyridinyl)benzamide
CID 103907650
3,5-dichloro-N-(5-methyl-2-pyridinyl)benzamide
CID 5063171
2-ethylsulfanyl-N-(5-methyl-2-pyridinyl)-4-(trifluoromethyl)benzamide
CID 118535345
N-(2,5-dimethylphenyl)-3,5-bis(trifluoromethyl)benzamide
CID 2094760
N-(5-methyl-2-pyridinyl)-4-methylsulfonylbenzamide
CID 16583790
N-(5-methyl-2-pyridinyl)-5-(trifluoromethyl)-1-[5-(trifluoromethyl)-2-pyridinyl]pyrazole-4-carboxamide
CID 25481374
1-[2-fluoro-5-(trifluoromethyl)phenyl]-3-(5-methyl-2-pyridinyl)urea
CID 71260039
5-amino-N-(5-methyl-2-pyridinyl)pyridine-3-carboxamide
CID 110488393
4-bromo-3-methyl-N-(5-methyl-2-pyridinyl)benzamide
CID 113338779
3,4-dimethoxy-N-(5-methyl-2-pyridinyl)benzamide;hydrochloride
CID 163326261
methyl 3-[(5-methyl-2-pyridinyl)carbamoyl]benzoate
CID 108799744
3-amino-5-methoxy-N-(5-methyl-2-pyridinyl)benzamide
CID 81090786

Frequently Asked Questions

What is the IUPAC name of N-(5-methyl-2-pyridinyl)-3,5-bis(trifluoromethyl)benzamide?
The IUPAC name of N-(5-methyl-2-pyridinyl)-3,5-bis(trifluoromethyl)benzamide (CID 43016681) is N-(5-methyl-2-pyridinyl)-3,5-bis(trifluoromethyl)benzamide.
What is the SMILES notation for N-(5-methyl-2-pyridinyl)-3,5-bis(trifluoromethyl)benzamide?
The canonical SMILES for N-(5-methyl-2-pyridinyl)-3,5-bis(trifluoromethyl)benzamide is Cc1ccc(NC(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)nc1.
What is the InChIKey of N-(5-methyl-2-pyridinyl)-3,5-bis(trifluoromethyl)benzamide?
The InChIKey is BXIZRXMMONGWET-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10F6N2O/c1-8-2-3-12(22-7-8)23-13(24)9-4-10(14(16,17)18)6-11(5-9)15(19,20)21/h2-7H,1H3,(H,22,23,24).
What are the key properties of N-(5-methyl-2-pyridinyl)-3,5-bis(trifluoromethyl)benzamide?
N-(5-methyl-2-pyridinyl)-3,5-bis(trifluoromethyl)benzamide has a molecular weight of 348.25 g/mol, XLogP of 4.68, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-methyl-2-pyridinyl)-3,5-bis(trifluoromethyl)benzamide is sourced from PubChem (CID 43016681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).