2-chloro-N-[2-(2-fluorophenyl)ethyl]-6-hydrazinylpyridine-4-carboxamide

C14H14ClFN4O — CID 62237463

IUPAC2-chloro-N-[2-(2-fluorophenyl)ethyl]-6-hydrazinylpyridine-4-carboxamide
SMILESNNc1cc(C(=O)NCCc2ccccc2F)cc(Cl)n1
InChIInChI=1S/C14H14ClFN4O/c15-12-7-10(8-13(19-12)20-17)14(21)18-6-5-9-3-1-2-4-11(9)16/h1-4,7-8H,5-6,17H2,(H,18,21)(H,19,20)
InChIKeyMMBNSZJWXXMUCM-UHFFFAOYSA-N
MW308.74 g/mol
LogP2.13
Rot. Bonds5

About 2-chloro-N-[2-(2-fluorophenyl)ethyl]-6-hydrazinylpyridine-4-carboxamide

2-chloro-N-[2-(2-fluorophenyl)ethyl]-6-hydrazinylpyridine-4-carboxamide (PubChem CID 62237463) has the molecular formula C14H14ClFN4O and a molecular weight of 308.74 g/mol. Its IUPAC name is 2-chloro-N-[2-(2-fluorophenyl)ethyl]-6-hydrazinylpyridine-4-carboxamide.

Molecular Properties

Compound Name2-chloro-N-[2-(2-fluorophenyl)ethyl]-6-hydrazinylpyridine-4-carboxamide
PubChem CID62237463
Molecular FormulaC14H14ClFN4O
Molecular Weight308.74 g/mol
Exact Mass308.08
IUPAC Name2-chloro-N-[2-(2-fluorophenyl)ethyl]-6-hydrazinylpyridine-4-carboxamide
SMILESNNc1cc(C(=O)NCCc2ccccc2F)cc(Cl)n1
InChIInChI=1S/C14H14ClFN4O/c15-12-7-10(8-13(19-12)20-17)14(21)18-6-5-9-3-1-2-4-11(9)16/h1-4,7-8H,5-6,17H2,(H,18,21)(H,19,20)
InChIKeyMMBNSZJWXXMUCM-UHFFFAOYSA-N
XLogP2.13
TPSA80.04 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.74
LogP ≤ 52.13
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-chloro-6-hydrazinyl-N-(2-pyridin-2-ylethyl)pyridine-4-carboxamide
CID 62236748
2-chloro-N-(2-fluorophenyl)-6-hydrazinylpyridine-4-carboxamide
CID 62247770
N-[2-(2-fluorophenyl)ethyl]-6-hydrazinylpyridine-3-carboxamide
CID 62236916
N-(2-acetamidoethyl)-2-chloro-6-hydrazinylpyridine-4-carboxamide
CID 62241958
N-[2-(2-fluorophenyl)ethyl]-6-hydrazinylpyridine-2-carboxamide
CID 62237279
N-(5-amino-5-oxopentyl)-2-chloro-6-hydrazinylpyridine-4-carboxamide
CID 114162817
2-chloro-N-[2-(2-fluorophenyl)ethyl]quinoline-6-carboxamide
CID 55731090
N-(2-amino-2-oxoethyl)-2-chloro-6-hydrazinylpyridine-4-carboxamide
CID 62248286
2-chloro-N-[(2-fluorophenyl)methyl]-6-methylpyridine-4-carboxamide
CID 113378285
N-[2-(2-fluorophenyl)ethyl]-2-[2-(2-fluorophenyl)ethylamino]pyridine-4-carboxamide
CID 109172463
2-chloro-6-hydrazinyl-N-[2-(1-methylimidazol-2-yl)ethyl]pyridine-4-carboxamide
CID 62248961
2-(2-chloroanilino)-N-[2-(2-fluorophenyl)ethyl]pyridine-4-carboxamide
CID 109172487

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-[2-(2-fluorophenyl)ethyl]-6-hydrazinylpyridine-4-carboxamide?
The IUPAC name of 2-chloro-N-[2-(2-fluorophenyl)ethyl]-6-hydrazinylpyridine-4-carboxamide (CID 62237463) is 2-chloro-N-[2-(2-fluorophenyl)ethyl]-6-hydrazinylpyridine-4-carboxamide.
What is the SMILES notation for 2-chloro-N-[2-(2-fluorophenyl)ethyl]-6-hydrazinylpyridine-4-carboxamide?
The canonical SMILES for 2-chloro-N-[2-(2-fluorophenyl)ethyl]-6-hydrazinylpyridine-4-carboxamide is NNc1cc(C(=O)NCCc2ccccc2F)cc(Cl)n1.
What is the InChIKey of 2-chloro-N-[2-(2-fluorophenyl)ethyl]-6-hydrazinylpyridine-4-carboxamide?
The InChIKey is MMBNSZJWXXMUCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14ClFN4O/c15-12-7-10(8-13(19-12)20-17)14(21)18-6-5-9-3-1-2-4-11(9)16/h1-4,7-8H,5-6,17H2,(H,18,21)(H,19,20).
What are the key properties of 2-chloro-N-[2-(2-fluorophenyl)ethyl]-6-hydrazinylpyridine-4-carboxamide?
2-chloro-N-[2-(2-fluorophenyl)ethyl]-6-hydrazinylpyridine-4-carboxamide has a molecular weight of 308.74 g/mol, XLogP of 2.13, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-[2-(2-fluorophenyl)ethyl]-6-hydrazinylpyridine-4-carboxamide is sourced from PubChem (CID 62237463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).