6-hydrazinyl-N-(2,2,2-trifluoroethyl)pyridine-2-carboxamide

C8H9F3N4O — CID 62235821

IUPAC6-hydrazinyl-N-(2,2,2-trifluoroethyl)pyridine-2-carboxamide
SMILESNNc1cccc(C(=O)NCC(F)(F)F)n1
InChIInChI=1S/C8H9F3N4O/c9-8(10,11)4-13-7(16)5-2-1-3-6(14-5)15-12/h1-3H,4,12H2,(H,13,16)(H,14,15)
InChIKeyPBMQRVZKEYDYHR-UHFFFAOYSA-N
MW234.18 g/mol
LogP0.66
Rot. Bonds3

About 6-hydrazinyl-N-(2,2,2-trifluoroethyl)pyridine-2-carboxamide

6-hydrazinyl-N-(2,2,2-trifluoroethyl)pyridine-2-carboxamide (PubChem CID 62235821) has the molecular formula C8H9F3N4O and a molecular weight of 234.18 g/mol. Its IUPAC name is 6-hydrazinyl-N-(2,2,2-trifluoroethyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name6-hydrazinyl-N-(2,2,2-trifluoroethyl)pyridine-2-carboxamide
PubChem CID62235821
Molecular FormulaC8H9F3N4O
Molecular Weight234.18 g/mol
Exact Mass234.07
IUPAC Name6-hydrazinyl-N-(2,2,2-trifluoroethyl)pyridine-2-carboxamide
SMILESNNc1cccc(C(=O)NCC(F)(F)F)n1
InChIInChI=1S/C8H9F3N4O/c9-8(10,11)4-13-7(16)5-2-1-3-6(14-5)15-12/h1-3H,4,12H2,(H,13,16)(H,14,15)
InChIKeyPBMQRVZKEYDYHR-UHFFFAOYSA-N
XLogP0.66
TPSA80.04 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.18
LogP ≤ 50.66
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 6-hydrazinyl-N-(2,2,2-trifluoroethyl)pyridine-2-carboxamide?
The IUPAC name of 6-hydrazinyl-N-(2,2,2-trifluoroethyl)pyridine-2-carboxamide (CID 62235821) is 6-hydrazinyl-N-(2,2,2-trifluoroethyl)pyridine-2-carboxamide.
What is the SMILES notation for 6-hydrazinyl-N-(2,2,2-trifluoroethyl)pyridine-2-carboxamide?
The canonical SMILES for 6-hydrazinyl-N-(2,2,2-trifluoroethyl)pyridine-2-carboxamide is NNc1cccc(C(=O)NCC(F)(F)F)n1.
What is the InChIKey of 6-hydrazinyl-N-(2,2,2-trifluoroethyl)pyridine-2-carboxamide?
The InChIKey is PBMQRVZKEYDYHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9F3N4O/c9-8(10,11)4-13-7(16)5-2-1-3-6(14-5)15-12/h1-3H,4,12H2,(H,13,16)(H,14,15).
What are the key properties of 6-hydrazinyl-N-(2,2,2-trifluoroethyl)pyridine-2-carboxamide?
6-hydrazinyl-N-(2,2,2-trifluoroethyl)pyridine-2-carboxamide has a molecular weight of 234.18 g/mol, XLogP of 0.66, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-hydrazinyl-N-(2,2,2-trifluoroethyl)pyridine-2-carboxamide is sourced from PubChem (CID 62235821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).