N-(5-chloropyrazin-2-yl)-5-(trifluoromethyl)pyridine-2-carboxamide

C11H6ClF3N4O — CID 107595663

IUPACN-(5-chloropyrazin-2-yl)-5-(trifluoromethyl)pyridine-2-carboxamide
SMILESO=C(Nc1cnc(Cl)cn1)c1ccc(C(F)(F)F)cn1
InChIInChI=1S/C11H6ClF3N4O/c12-8-4-18-9(5-17-8)19-10(20)7-2-1-6(3-16-7)11(13,14)15/h1-5H,(H,18,19,20)
InChIKeyIJFZGVIKMXOTNE-UHFFFAOYSA-N
MW302.64 g/mol
LogP2.80
Rot. Bonds2

About N-(5-chloropyrazin-2-yl)-5-(trifluoromethyl)pyridine-2-carboxamide

N-(5-chloropyrazin-2-yl)-5-(trifluoromethyl)pyridine-2-carboxamide (PubChem CID 107595663) has the molecular formula C11H6ClF3N4O and a molecular weight of 302.64 g/mol. Its IUPAC name is N-(5-chloropyrazin-2-yl)-5-(trifluoromethyl)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(5-chloropyrazin-2-yl)-5-(trifluoromethyl)pyridine-2-carboxamide
PubChem CID107595663
Molecular FormulaC11H6ClF3N4O
Molecular Weight302.64 g/mol
Exact Mass302.02
IUPAC NameN-(5-chloropyrazin-2-yl)-5-(trifluoromethyl)pyridine-2-carboxamide
SMILESO=C(Nc1cnc(Cl)cn1)c1ccc(C(F)(F)F)cn1
InChIInChI=1S/C11H6ClF3N4O/c12-8-4-18-9(5-17-8)19-10(20)7-2-1-6(3-16-7)11(13,14)15/h1-5H,(H,18,19,20)
InChIKeyIJFZGVIKMXOTNE-UHFFFAOYSA-N
XLogP2.80
TPSA67.77 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.64
LogP ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(5-bromopyrazin-2-yl)-5-(trifluoromethyl)pyridine-2-carboxamide
CID 115692921
5-amino-N-[5-(trifluoromethyl)-2-pyridinyl]pyridine-2-carboxamide
CID 24896989
N-(4-bromo-2-pyridinyl)-5-(trifluoromethyl)pyridine-2-carboxamide
CID 102674347
N-[5-(trifluoromethyl)-2-pyridinyl]-1,3-thiazole-4-carboxamide
CID 84554131
N-(5-chloropyrazin-2-yl)-6-methylpyridine-2-carboxamide
CID 104964202
N-(2-amino-4-chlorophenyl)-5-(trifluoromethyl)pyridine-2-carboxamide
CID 114908264
N-(5-chloropyrazin-2-yl)-2,3,4,5,6-pentafluorobenzamide
CID 107595794
N-(3-hydroxycyclobutyl)-5-(trifluoromethyl)pyridine-2-carboxamide
CID 114909152
N-(6-chloro-5-methyl-3-pyridinyl)-5-(trifluoromethyl)pyridine-2-carboxamide
CID 103745352
N-(5-chloropyrazin-2-yl)-4-propan-2-ylbenzamide
CID 104964161
N-[4-(aminomethyl)phenyl]-5-(trifluoromethyl)pyridine-2-carboxamide
CID 114750435
N-(5-chloropyrazin-2-yl)-2-hydroxybenzamide
CID 107595825

Frequently Asked Questions

What is the IUPAC name of N-(5-chloropyrazin-2-yl)-5-(trifluoromethyl)pyridine-2-carboxamide?
The IUPAC name of N-(5-chloropyrazin-2-yl)-5-(trifluoromethyl)pyridine-2-carboxamide (CID 107595663) is N-(5-chloropyrazin-2-yl)-5-(trifluoromethyl)pyridine-2-carboxamide.
What is the SMILES notation for N-(5-chloropyrazin-2-yl)-5-(trifluoromethyl)pyridine-2-carboxamide?
The canonical SMILES for N-(5-chloropyrazin-2-yl)-5-(trifluoromethyl)pyridine-2-carboxamide is O=C(Nc1cnc(Cl)cn1)c1ccc(C(F)(F)F)cn1.
What is the InChIKey of N-(5-chloropyrazin-2-yl)-5-(trifluoromethyl)pyridine-2-carboxamide?
The InChIKey is IJFZGVIKMXOTNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H6ClF3N4O/c12-8-4-18-9(5-17-8)19-10(20)7-2-1-6(3-16-7)11(13,14)15/h1-5H,(H,18,19,20).
What are the key properties of N-(5-chloropyrazin-2-yl)-5-(trifluoromethyl)pyridine-2-carboxamide?
N-(5-chloropyrazin-2-yl)-5-(trifluoromethyl)pyridine-2-carboxamide has a molecular weight of 302.64 g/mol, XLogP of 2.80, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloropyrazin-2-yl)-5-(trifluoromethyl)pyridine-2-carboxamide is sourced from PubChem (CID 107595663), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).