5-hydrazinyl-N-(4-methoxyphenyl)pyridine-2-carboxamide

C13H14N4O2 — CID 113436268

IUPAC5-hydrazinyl-N-(4-methoxyphenyl)pyridine-2-carboxamide
SMILESCOc1ccc(NC(=O)c2ccc(NN)cn2)cc1
InChIInChI=1S/C13H14N4O2/c1-19-11-5-2-9(3-6-11)16-13(18)12-7-4-10(17-14)8-15-12/h2-8,17H,14H2,1H3,(H,16,18)
InChIKeyGSEOGTCLELZRSX-UHFFFAOYSA-N
MW258.28 g/mol
LogP1.63
Rot. Bonds4

About 5-hydrazinyl-N-(4-methoxyphenyl)pyridine-2-carboxamide

5-hydrazinyl-N-(4-methoxyphenyl)pyridine-2-carboxamide (PubChem CID 113436268) has the molecular formula C13H14N4O2 and a molecular weight of 258.28 g/mol. Its IUPAC name is 5-hydrazinyl-N-(4-methoxyphenyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name5-hydrazinyl-N-(4-methoxyphenyl)pyridine-2-carboxamide
PubChem CID113436268
Molecular FormulaC13H14N4O2
Molecular Weight258.28 g/mol
Exact Mass258.11
IUPAC Name5-hydrazinyl-N-(4-methoxyphenyl)pyridine-2-carboxamide
SMILESCOc1ccc(NC(=O)c2ccc(NN)cn2)cc1
InChIInChI=1S/C13H14N4O2/c1-19-11-5-2-9(3-6-11)16-13(18)12-7-4-10(17-14)8-15-12/h2-8,17H,14H2,1H3,(H,16,18)
InChIKeyGSEOGTCLELZRSX-UHFFFAOYSA-N
XLogP1.63
TPSA89.27 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.28
LogP ≤ 51.63
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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 5-hydrazinyl-N-(4-methoxyphenyl)pyridine-2-carboxamide?
The IUPAC name of 5-hydrazinyl-N-(4-methoxyphenyl)pyridine-2-carboxamide (CID 113436268) is 5-hydrazinyl-N-(4-methoxyphenyl)pyridine-2-carboxamide.
What is the SMILES notation for 5-hydrazinyl-N-(4-methoxyphenyl)pyridine-2-carboxamide?
The canonical SMILES for 5-hydrazinyl-N-(4-methoxyphenyl)pyridine-2-carboxamide is COc1ccc(NC(=O)c2ccc(NN)cn2)cc1.
What is the InChIKey of 5-hydrazinyl-N-(4-methoxyphenyl)pyridine-2-carboxamide?
The InChIKey is GSEOGTCLELZRSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N4O2/c1-19-11-5-2-9(3-6-11)16-13(18)12-7-4-10(17-14)8-15-12/h2-8,17H,14H2,1H3,(H,16,18).
What are the key properties of 5-hydrazinyl-N-(4-methoxyphenyl)pyridine-2-carboxamide?
5-hydrazinyl-N-(4-methoxyphenyl)pyridine-2-carboxamide has a molecular weight of 258.28 g/mol, XLogP of 1.63, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-hydrazinyl-N-(4-methoxyphenyl)pyridine-2-carboxamide is sourced from PubChem (CID 113436268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).