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

C10H13F3N4O — CID 62236803

IUPACN-ethyl-6-hydrazinyl-N-(2,2,2-trifluoroethyl)pyridine-2-carboxamide
SMILESCCN(CC(F)(F)F)C(=O)c1cccc(NN)n1
InChIInChI=1S/C10H13F3N4O/c1-2-17(6-10(11,12)13)9(18)7-4-3-5-8(15-7)16-14/h3-5H,2,6,14H2,1H3,(H,15,16)
InChIKeyXBHTZWWGPOALSK-UHFFFAOYSA-N
MW262.23 g/mol
LogP1.39
Rot. Bonds4

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

N-ethyl-6-hydrazinyl-N-(2,2,2-trifluoroethyl)pyridine-2-carboxamide (PubChem CID 62236803) has the molecular formula C10H13F3N4O and a molecular weight of 262.23 g/mol. Its IUPAC name is N-ethyl-6-hydrazinyl-N-(2,2,2-trifluoroethyl)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-ethyl-6-hydrazinyl-N-(2,2,2-trifluoroethyl)pyridine-2-carboxamide
PubChem CID62236803
Molecular FormulaC10H13F3N4O
Molecular Weight262.23 g/mol
Exact Mass262.10
IUPAC NameN-ethyl-6-hydrazinyl-N-(2,2,2-trifluoroethyl)pyridine-2-carboxamide
SMILESCCN(CC(F)(F)F)C(=O)c1cccc(NN)n1
InChIInChI=1S/C10H13F3N4O/c1-2-17(6-10(11,12)13)9(18)7-4-3-5-8(15-7)16-14/h3-5H,2,6,14H2,1H3,(H,15,16)
InChIKeyXBHTZWWGPOALSK-UHFFFAOYSA-N
XLogP1.39
TPSA71.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.23
LogP ≤ 51.39
H-Bond Donors ≤ 52
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 N-ethyl-6-hydrazinyl-N-(2,2,2-trifluoroethyl)pyridine-2-carboxamide?
The IUPAC name of N-ethyl-6-hydrazinyl-N-(2,2,2-trifluoroethyl)pyridine-2-carboxamide (CID 62236803) is N-ethyl-6-hydrazinyl-N-(2,2,2-trifluoroethyl)pyridine-2-carboxamide.
What is the SMILES notation for N-ethyl-6-hydrazinyl-N-(2,2,2-trifluoroethyl)pyridine-2-carboxamide?
The canonical SMILES for N-ethyl-6-hydrazinyl-N-(2,2,2-trifluoroethyl)pyridine-2-carboxamide is CCN(CC(F)(F)F)C(=O)c1cccc(NN)n1.
What is the InChIKey of N-ethyl-6-hydrazinyl-N-(2,2,2-trifluoroethyl)pyridine-2-carboxamide?
The InChIKey is XBHTZWWGPOALSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13F3N4O/c1-2-17(6-10(11,12)13)9(18)7-4-3-5-8(15-7)16-14/h3-5H,2,6,14H2,1H3,(H,15,16).
What are the key properties of N-ethyl-6-hydrazinyl-N-(2,2,2-trifluoroethyl)pyridine-2-carboxamide?
N-ethyl-6-hydrazinyl-N-(2,2,2-trifluoroethyl)pyridine-2-carboxamide has a molecular weight of 262.23 g/mol, XLogP of 1.39, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-6-hydrazinyl-N-(2,2,2-trifluoroethyl)pyridine-2-carboxamide is sourced from PubChem (CID 62236803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).