4-hydrazinyl-N-[3-(trifluoromethyl)phenyl]pyridine-3-carboxamide

C13H11F3N4O — CID 81240010

IUPAC4-hydrazinyl-N-[3-(trifluoromethyl)phenyl]pyridine-3-carboxamide
SMILESNNc1ccncc1C(=O)Nc1cccc(C(F)(F)F)c1
InChIInChI=1S/C13H11F3N4O/c14-13(15,16)8-2-1-3-9(6-8)19-12(21)10-7-18-5-4-11(10)20-17/h1-7H,17H2,(H,18,20)(H,19,21)
InChIKeyJIJRWASRAVFOGS-UHFFFAOYSA-N
MW296.25 g/mol
LogP2.64
Rot. Bonds3

About 4-hydrazinyl-N-[3-(trifluoromethyl)phenyl]pyridine-3-carboxamide

4-hydrazinyl-N-[3-(trifluoromethyl)phenyl]pyridine-3-carboxamide (PubChem CID 81240010) has the molecular formula C13H11F3N4O and a molecular weight of 296.25 g/mol. Its IUPAC name is 4-hydrazinyl-N-[3-(trifluoromethyl)phenyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name4-hydrazinyl-N-[3-(trifluoromethyl)phenyl]pyridine-3-carboxamide
PubChem CID81240010
Molecular FormulaC13H11F3N4O
Molecular Weight296.25 g/mol
Exact Mass296.09
IUPAC Name4-hydrazinyl-N-[3-(trifluoromethyl)phenyl]pyridine-3-carboxamide
SMILESNNc1ccncc1C(=O)Nc1cccc(C(F)(F)F)c1
InChIInChI=1S/C13H11F3N4O/c14-13(15,16)8-2-1-3-9(6-8)19-12(21)10-7-18-5-4-11(10)20-17/h1-7H,17H2,(H,18,20)(H,19,21)
InChIKeyJIJRWASRAVFOGS-UHFFFAOYSA-N
XLogP2.64
TPSA80.04 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.25
LogP ≤ 52.64
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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Related Compounds

3-hydrazinyl-N-[3-(trifluoromethyl)phenyl]pyridine-4-carboxamide
CID 105071549
4-methyl-N-[3-(trifluoromethyl)phenyl]pyridine-3-carboxamide
CID 110860828
1-(3-amino-4-pyridinyl)-3-[3-(trifluoromethyl)phenyl]urea
CID 63063127
4-hydrazinyl-N-[3-(trifluoromethyl)phenyl]benzamide
CID 62238140
5-hydrazinyl-N-[3-(trifluoromethyl)phenyl]pyrazine-2-carboxamide
CID 107377456
5-(trifluoromethyl)-N-[3-(trifluoromethyl)phenyl]-1H-pyrazole-4-carboxamide
CID 47801183
2-hydroxy-4-(trifluoromethyl)-N-[3-(trifluoromethyl)phenyl]benzamide
CID 154341283
2-amino-5-chloro-N-[3-(trifluoromethyl)phenyl]pyridine-4-carboxamide
CID 114921483
3-fluoro-N-[2-(trifluoromethyl)-4-[[3-(trifluoromethyl)phenyl]carbamoylamino]phenyl]pyridine-4-carboxamide
CID 121264530
5-amino-2-hydroxy-N-[3-(trifluoromethyl)phenyl]benzamide
CID 121356240
5-amino-2-chloro-N-[3-(trifluoromethyl)phenyl]benzamide
CID 28543225
2,3,4,5-tetrafluoro-N-[3-(trifluoromethyl)phenyl]benzamide
CID 4542565

Frequently Asked Questions

What is the IUPAC name of 4-hydrazinyl-N-[3-(trifluoromethyl)phenyl]pyridine-3-carboxamide?
The IUPAC name of 4-hydrazinyl-N-[3-(trifluoromethyl)phenyl]pyridine-3-carboxamide (CID 81240010) is 4-hydrazinyl-N-[3-(trifluoromethyl)phenyl]pyridine-3-carboxamide.
What is the SMILES notation for 4-hydrazinyl-N-[3-(trifluoromethyl)phenyl]pyridine-3-carboxamide?
The canonical SMILES for 4-hydrazinyl-N-[3-(trifluoromethyl)phenyl]pyridine-3-carboxamide is NNc1ccncc1C(=O)Nc1cccc(C(F)(F)F)c1.
What is the InChIKey of 4-hydrazinyl-N-[3-(trifluoromethyl)phenyl]pyridine-3-carboxamide?
The InChIKey is JIJRWASRAVFOGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11F3N4O/c14-13(15,16)8-2-1-3-9(6-8)19-12(21)10-7-18-5-4-11(10)20-17/h1-7H,17H2,(H,18,20)(H,19,21).
What are the key properties of 4-hydrazinyl-N-[3-(trifluoromethyl)phenyl]pyridine-3-carboxamide?
4-hydrazinyl-N-[3-(trifluoromethyl)phenyl]pyridine-3-carboxamide has a molecular weight of 296.25 g/mol, XLogP of 2.64, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydrazinyl-N-[3-(trifluoromethyl)phenyl]pyridine-3-carboxamide is sourced from PubChem (CID 81240010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).