N-pyrimidin-2-yl-5-(trifluoromethyl)pyridine-3-carboxamide

C11H7F3N4O — CID 154758058

IUPACN-pyrimidin-2-yl-5-(trifluoromethyl)pyridine-3-carboxamide
SMILESO=C(Nc1ncccn1)c1cncc(C(F)(F)F)c1
InChIInChI=1S/C11H7F3N4O/c12-11(13,14)8-4-7(5-15-6-8)9(19)18-10-16-2-1-3-17-10/h1-6H,(H,16,17,18,19)
InChIKeyLZSRNAGWGWBSKK-UHFFFAOYSA-N
MW268.20 g/mol
LogP2.14
Rot. Bonds2

About N-pyrimidin-2-yl-5-(trifluoromethyl)pyridine-3-carboxamide

N-pyrimidin-2-yl-5-(trifluoromethyl)pyridine-3-carboxamide (PubChem CID 154758058) has the molecular formula C11H7F3N4O and a molecular weight of 268.20 g/mol. Its IUPAC name is N-pyrimidin-2-yl-5-(trifluoromethyl)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-pyrimidin-2-yl-5-(trifluoromethyl)pyridine-3-carboxamide
PubChem CID154758058
Molecular FormulaC11H7F3N4O
Molecular Weight268.20 g/mol
Exact Mass268.06
IUPAC NameN-pyrimidin-2-yl-5-(trifluoromethyl)pyridine-3-carboxamide
SMILESO=C(Nc1ncccn1)c1cncc(C(F)(F)F)c1
InChIInChI=1S/C11H7F3N4O/c12-11(13,14)8-4-7(5-15-6-8)9(19)18-10-16-2-1-3-17-10/h1-6H,(H,16,17,18,19)
InChIKeyLZSRNAGWGWBSKK-UHFFFAOYSA-N
XLogP2.14
TPSA67.77 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.20
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-bromo-N-pyrimidin-2-ylpyridine-3-carboxamide
CID 29367937
N-[4-(trifluoromethyl)phenyl]-5-[[5-(trifluoromethyl)pyridine-3-carbonyl]amino]-1,3-thiazole-4-carboxamide
CID 165073935
2-hydroxy-1-[5-(trifluoromethyl)-3-pyridinyl]prop-2-en-1-one
CID 174382353
4-fluoro-N-pyrimidin-2-ylbenzamide
CID 797393
4-methyl-N-[5-(trifluoromethyl)-3-pyridinyl]benzamide
CID 174184894
N-pyrimidin-2-ylbenzamide;silver
CID 175574792
N-[2-methylsulfonyl-5-(trifluoromethyl)-3-pyridinyl]pyridine-3-carboxamide
CID 171502365
5-chloro-6-(methylamino)-N-pyrimidin-2-ylpyridine-3-carboxamide
CID 62172629
4-hydroxy-3,5-dimethyl-N-pyrimidin-2-ylbenzamide
CID 21109041
5-imidazo[1,2-b]pyridazin-3-yl-N-[3-(trifluoromethyl)phenyl]pyridine-3-carboxamide
CID 67891392
N-(3,4-dihydro-2H-chromen-3-yl)-5-(trifluoromethyl)pyridine-3-carboxamide
CID 154758238
N-[3-bromo-5-(trifluoromethyl)phenyl]-5-hydroxypyridine-3-carboxamide
CID 65490043

Frequently Asked Questions

What is the IUPAC name of N-pyrimidin-2-yl-5-(trifluoromethyl)pyridine-3-carboxamide?
The IUPAC name of N-pyrimidin-2-yl-5-(trifluoromethyl)pyridine-3-carboxamide (CID 154758058) is N-pyrimidin-2-yl-5-(trifluoromethyl)pyridine-3-carboxamide.
What is the SMILES notation for N-pyrimidin-2-yl-5-(trifluoromethyl)pyridine-3-carboxamide?
The canonical SMILES for N-pyrimidin-2-yl-5-(trifluoromethyl)pyridine-3-carboxamide is O=C(Nc1ncccn1)c1cncc(C(F)(F)F)c1.
What is the InChIKey of N-pyrimidin-2-yl-5-(trifluoromethyl)pyridine-3-carboxamide?
The InChIKey is LZSRNAGWGWBSKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7F3N4O/c12-11(13,14)8-4-7(5-15-6-8)9(19)18-10-16-2-1-3-17-10/h1-6H,(H,16,17,18,19).
What are the key properties of N-pyrimidin-2-yl-5-(trifluoromethyl)pyridine-3-carboxamide?
N-pyrimidin-2-yl-5-(trifluoromethyl)pyridine-3-carboxamide has a molecular weight of 268.20 g/mol, XLogP of 2.14, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-pyrimidin-2-yl-5-(trifluoromethyl)pyridine-3-carboxamide is sourced from PubChem (CID 154758058), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).