3-chloro-6-hydrazinyl-N-methyl-N-(2,2,2-trifluoroethyl)pyridine-2-carboxamide

C9H10ClF3N4O — CID 62235796

IUPAC3-chloro-6-hydrazinyl-N-methyl-N-(2,2,2-trifluoroethyl)pyridine-2-carboxamide
SMILESCN(CC(F)(F)F)C(=O)c1nc(NN)ccc1Cl
InChIInChI=1S/C9H10ClF3N4O/c1-17(4-9(11,12)13)8(18)7-5(10)2-3-6(15-7)16-14/h2-3H,4,14H2,1H3,(H,15,16)
InChIKeyBKEWYHSXFBRFGE-UHFFFAOYSA-N
MW282.65 g/mol
LogP1.65
Rot. Bonds3

About 3-chloro-6-hydrazinyl-N-methyl-N-(2,2,2-trifluoroethyl)pyridine-2-carboxamide

3-chloro-6-hydrazinyl-N-methyl-N-(2,2,2-trifluoroethyl)pyridine-2-carboxamide (PubChem CID 62235796) has the molecular formula C9H10ClF3N4O and a molecular weight of 282.65 g/mol. Its IUPAC name is 3-chloro-6-hydrazinyl-N-methyl-N-(2,2,2-trifluoroethyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name3-chloro-6-hydrazinyl-N-methyl-N-(2,2,2-trifluoroethyl)pyridine-2-carboxamide
PubChem CID62235796
Molecular FormulaC9H10ClF3N4O
Molecular Weight282.65 g/mol
Exact Mass282.05
IUPAC Name3-chloro-6-hydrazinyl-N-methyl-N-(2,2,2-trifluoroethyl)pyridine-2-carboxamide
SMILESCN(CC(F)(F)F)C(=O)c1nc(NN)ccc1Cl
InChIInChI=1S/C9H10ClF3N4O/c1-17(4-9(11,12)13)8(18)7-5(10)2-3-6(15-7)16-14/h2-3H,4,14H2,1H3,(H,15,16)
InChIKeyBKEWYHSXFBRFGE-UHFFFAOYSA-N
XLogP1.65
TPSA71.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.65
LogP ≤ 51.65
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 3-chloro-6-hydrazinyl-N-methyl-N-(2,2,2-trifluoroethyl)pyridine-2-carboxamide?
The IUPAC name of 3-chloro-6-hydrazinyl-N-methyl-N-(2,2,2-trifluoroethyl)pyridine-2-carboxamide (CID 62235796) is 3-chloro-6-hydrazinyl-N-methyl-N-(2,2,2-trifluoroethyl)pyridine-2-carboxamide.
What is the SMILES notation for 3-chloro-6-hydrazinyl-N-methyl-N-(2,2,2-trifluoroethyl)pyridine-2-carboxamide?
The canonical SMILES for 3-chloro-6-hydrazinyl-N-methyl-N-(2,2,2-trifluoroethyl)pyridine-2-carboxamide is CN(CC(F)(F)F)C(=O)c1nc(NN)ccc1Cl.
What is the InChIKey of 3-chloro-6-hydrazinyl-N-methyl-N-(2,2,2-trifluoroethyl)pyridine-2-carboxamide?
The InChIKey is BKEWYHSXFBRFGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10ClF3N4O/c1-17(4-9(11,12)13)8(18)7-5(10)2-3-6(15-7)16-14/h2-3H,4,14H2,1H3,(H,15,16).
What are the key properties of 3-chloro-6-hydrazinyl-N-methyl-N-(2,2,2-trifluoroethyl)pyridine-2-carboxamide?
3-chloro-6-hydrazinyl-N-methyl-N-(2,2,2-trifluoroethyl)pyridine-2-carboxamide has a molecular weight of 282.65 g/mol, XLogP of 1.65, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-6-hydrazinyl-N-methyl-N-(2,2,2-trifluoroethyl)pyridine-2-carboxamide is sourced from PubChem (CID 62235796), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).