2-methyl-6-(trifluoromethyl)-N-[5-(trifluoromethyl)-2-pyridinyl]pyridine-3-carboxamide

C14H9F6N3O — CID 2814312

IUPAC2-methyl-6-(trifluoromethyl)-N-[5-(trifluoromethyl)-2-pyridinyl]pyridine-3-carboxamide
SMILESCc1nc(C(F)(F)F)ccc1C(=O)Nc1ccc(C(F)(F)F)cn1
InChIInChI=1S/C14H9F6N3O/c1-7-9(3-4-10(22-7)14(18,19)20)12(24)23-11-5-2-8(6-21-11)13(15,16)17/h2-6H,1H3,(H,21,23,24)
InChIKeyZQDHAFLEFHSSFK-UHFFFAOYSA-N
MW349.23 g/mol
LogP4.07
Rot. Bonds2

About 2-methyl-6-(trifluoromethyl)-N-[5-(trifluoromethyl)-2-pyridinyl]pyridine-3-carboxamide

2-methyl-6-(trifluoromethyl)-N-[5-(trifluoromethyl)-2-pyridinyl]pyridine-3-carboxamide (PubChem CID 2814312) has the molecular formula C14H9F6N3O and a molecular weight of 349.23 g/mol. Its IUPAC name is 2-methyl-6-(trifluoromethyl)-N-[5-(trifluoromethyl)-2-pyridinyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name2-methyl-6-(trifluoromethyl)-N-[5-(trifluoromethyl)-2-pyridinyl]pyridine-3-carboxamide
PubChem CID2814312
Molecular FormulaC14H9F6N3O
Molecular Weight349.23 g/mol
Exact Mass349.06
IUPAC Name2-methyl-6-(trifluoromethyl)-N-[5-(trifluoromethyl)-2-pyridinyl]pyridine-3-carboxamide
SMILESCc1nc(C(F)(F)F)ccc1C(=O)Nc1ccc(C(F)(F)F)cn1
InChIInChI=1S/C14H9F6N3O/c1-7-9(3-4-10(22-7)14(18,19)20)12(24)23-11-5-2-8(6-21-11)13(15,16)17/h2-6H,1H3,(H,21,23,24)
InChIKeyZQDHAFLEFHSSFK-UHFFFAOYSA-N
XLogP4.07
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.23
LogP ≤ 54.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-(trifluoromethyl)-N-[5-(trifluoromethyl)-2-pyridinyl]pyridine-3-carboxamide?
The IUPAC name of 2-methyl-6-(trifluoromethyl)-N-[5-(trifluoromethyl)-2-pyridinyl]pyridine-3-carboxamide (CID 2814312) is 2-methyl-6-(trifluoromethyl)-N-[5-(trifluoromethyl)-2-pyridinyl]pyridine-3-carboxamide.
What is the SMILES notation for 2-methyl-6-(trifluoromethyl)-N-[5-(trifluoromethyl)-2-pyridinyl]pyridine-3-carboxamide?
The canonical SMILES for 2-methyl-6-(trifluoromethyl)-N-[5-(trifluoromethyl)-2-pyridinyl]pyridine-3-carboxamide is Cc1nc(C(F)(F)F)ccc1C(=O)Nc1ccc(C(F)(F)F)cn1.
What is the InChIKey of 2-methyl-6-(trifluoromethyl)-N-[5-(trifluoromethyl)-2-pyridinyl]pyridine-3-carboxamide?
The InChIKey is ZQDHAFLEFHSSFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9F6N3O/c1-7-9(3-4-10(22-7)14(18,19)20)12(24)23-11-5-2-8(6-21-11)13(15,16)17/h2-6H,1H3,(H,21,23,24).
What are the key properties of 2-methyl-6-(trifluoromethyl)-N-[5-(trifluoromethyl)-2-pyridinyl]pyridine-3-carboxamide?
2-methyl-6-(trifluoromethyl)-N-[5-(trifluoromethyl)-2-pyridinyl]pyridine-3-carboxamide has a molecular weight of 349.23 g/mol, XLogP of 4.07, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-(trifluoromethyl)-N-[5-(trifluoromethyl)-2-pyridinyl]pyridine-3-carboxamide is sourced from PubChem (CID 2814312), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).