5-hydrazinyl-N-(3,4,5-trifluorophenyl)pyrazine-2-carboxamide

C11H8F3N5O — CID 107378182

IUPAC5-hydrazinyl-N-(3,4,5-trifluorophenyl)pyrazine-2-carboxamide
SMILESNNc1cnc(C(=O)Nc2cc(F)c(F)c(F)c2)cn1
InChIInChI=1S/C11H8F3N5O/c12-6-1-5(2-7(13)10(6)14)18-11(20)8-3-17-9(19-15)4-16-8/h1-4H,15H2,(H,17,19)(H,18,20)
InChIKeyJWEUBFAULZPUTL-UHFFFAOYSA-N
MW283.21 g/mol
LogP1.43
Rot. Bonds3

About 5-hydrazinyl-N-(3,4,5-trifluorophenyl)pyrazine-2-carboxamide

5-hydrazinyl-N-(3,4,5-trifluorophenyl)pyrazine-2-carboxamide (PubChem CID 107378182) has the molecular formula C11H8F3N5O and a molecular weight of 283.21 g/mol. Its IUPAC name is 5-hydrazinyl-N-(3,4,5-trifluorophenyl)pyrazine-2-carboxamide.

Molecular Properties

Compound Name5-hydrazinyl-N-(3,4,5-trifluorophenyl)pyrazine-2-carboxamide
PubChem CID107378182
Molecular FormulaC11H8F3N5O
Molecular Weight283.21 g/mol
Exact Mass283.07
IUPAC Name5-hydrazinyl-N-(3,4,5-trifluorophenyl)pyrazine-2-carboxamide
SMILESNNc1cnc(C(=O)Nc2cc(F)c(F)c(F)c2)cn1
InChIInChI=1S/C11H8F3N5O/c12-6-1-5(2-7(13)10(6)14)18-11(20)8-3-17-9(19-15)4-16-8/h1-4H,15H2,(H,17,19)(H,18,20)
InChIKeyJWEUBFAULZPUTL-UHFFFAOYSA-N
XLogP1.43
TPSA92.93 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.21
LogP ≤ 51.43
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'halogenated_ring_2', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

6-hydrazinyl-N-(3,4,5-trifluorophenyl)pyrazine-2-carboxamide
CID 114036287
5-hydrazinyl-N-pyrimidin-5-ylpyrazine-2-carboxamide
CID 107590045
N-(4-bromophenyl)-5-hydrazinylpyrazine-2-carboxamide
CID 107377733
5-hydrazinyl-N-thiophen-3-ylpyrazine-2-carboxamide
CID 107378459
5-hydrazinyl-N-[3-(trifluoromethyl)phenyl]pyrazine-2-carboxamide
CID 107377456
5-bromo-N-(3,4,5-trifluorophenyl)pyridine-2-carboxamide
CID 55152694
5-hydrazinyl-N-(4-methoxyphenyl)pyrazine-2-carboxamide
CID 107377590
N-(2-fluoro-5-nitrophenyl)-5-hydrazinylpyrazine-2-carboxamide
CID 107378095
5-chloro-N-(3,5-dichloro-4-fluorophenyl)pyrazine-2-carboxamide
CID 107573378
5-hydrazinyl-N-(3-methoxyphenyl)pyrazine-2-carboxamide
CID 107377927
N-(2-bromo-6-chloro-4-fluorophenyl)-5-hydrazinylpyrazine-2-carboxamide
CID 107616865
N-(4-fluoro-2-methoxyphenyl)-5-hydrazinylpyrazine-2-carboxamide
CID 107377845

Frequently Asked Questions

What is the IUPAC name of 5-hydrazinyl-N-(3,4,5-trifluorophenyl)pyrazine-2-carboxamide?
The IUPAC name of 5-hydrazinyl-N-(3,4,5-trifluorophenyl)pyrazine-2-carboxamide (CID 107378182) is 5-hydrazinyl-N-(3,4,5-trifluorophenyl)pyrazine-2-carboxamide.
What is the SMILES notation for 5-hydrazinyl-N-(3,4,5-trifluorophenyl)pyrazine-2-carboxamide?
The canonical SMILES for 5-hydrazinyl-N-(3,4,5-trifluorophenyl)pyrazine-2-carboxamide is NNc1cnc(C(=O)Nc2cc(F)c(F)c(F)c2)cn1.
What is the InChIKey of 5-hydrazinyl-N-(3,4,5-trifluorophenyl)pyrazine-2-carboxamide?
The InChIKey is JWEUBFAULZPUTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8F3N5O/c12-6-1-5(2-7(13)10(6)14)18-11(20)8-3-17-9(19-15)4-16-8/h1-4H,15H2,(H,17,19)(H,18,20).
What are the key properties of 5-hydrazinyl-N-(3,4,5-trifluorophenyl)pyrazine-2-carboxamide?
5-hydrazinyl-N-(3,4,5-trifluorophenyl)pyrazine-2-carboxamide has a molecular weight of 283.21 g/mol, XLogP of 1.43, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-hydrazinyl-N-(3,4,5-trifluorophenyl)pyrazine-2-carboxamide is sourced from PubChem (CID 107378182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).