2-ethoxy-N'-(2-pyrrol-1-ylbenzoyl)pyridine-3-carbohydrazide

C19H18N4O3 — CID 24819857

IUPAC2-ethoxy-N'-(2-pyrrol-1-ylbenzoyl)pyridine-3-carbohydrazide
SMILESCCOc1ncccc1C(=O)NNC(=O)c1ccccc1-n1cccc1
InChIInChI=1S/C19H18N4O3/c1-2-26-19-15(9-7-11-20-19)18(25)22-21-17(24)14-8-3-4-10-16(14)23-12-5-6-13-23/h3-13H,2H2,1H3,(H,21,24)(H,22,25)
InChIKeyGQYYUUIZLYPXRV-UHFFFAOYSA-N
MW350.38 g/mol
LogP2.35
Rot. Bonds5

About 2-ethoxy-N'-(2-pyrrol-1-ylbenzoyl)pyridine-3-carbohydrazide

2-ethoxy-N'-(2-pyrrol-1-ylbenzoyl)pyridine-3-carbohydrazide (PubChem CID 24819857) has the molecular formula C19H18N4O3 and a molecular weight of 350.38 g/mol. Its IUPAC name is 2-ethoxy-N'-(2-pyrrol-1-ylbenzoyl)pyridine-3-carbohydrazide.

Molecular Properties

Compound Name2-ethoxy-N'-(2-pyrrol-1-ylbenzoyl)pyridine-3-carbohydrazide
PubChem CID24819857
Molecular FormulaC19H18N4O3
Molecular Weight350.38 g/mol
Exact Mass350.14
IUPAC Name2-ethoxy-N'-(2-pyrrol-1-ylbenzoyl)pyridine-3-carbohydrazide
SMILESCCOc1ncccc1C(=O)NNC(=O)c1ccccc1-n1cccc1
InChIInChI=1S/C19H18N4O3/c1-2-26-19-15(9-7-11-20-19)18(25)22-21-17(24)14-8-3-4-10-16(14)23-12-5-6-13-23/h3-13H,2H2,1H3,(H,21,24)(H,22,25)
InChIKeyGQYYUUIZLYPXRV-UHFFFAOYSA-N
XLogP2.35
TPSA85.25 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.38
LogP ≤ 52.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N'-(2-pyrrol-1-ylbenzoyl)pyridine-3-carbohydrazide?
The IUPAC name of 2-ethoxy-N'-(2-pyrrol-1-ylbenzoyl)pyridine-3-carbohydrazide (CID 24819857) is 2-ethoxy-N'-(2-pyrrol-1-ylbenzoyl)pyridine-3-carbohydrazide.
What is the SMILES notation for 2-ethoxy-N'-(2-pyrrol-1-ylbenzoyl)pyridine-3-carbohydrazide?
The canonical SMILES for 2-ethoxy-N'-(2-pyrrol-1-ylbenzoyl)pyridine-3-carbohydrazide is CCOc1ncccc1C(=O)NNC(=O)c1ccccc1-n1cccc1.
What is the InChIKey of 2-ethoxy-N'-(2-pyrrol-1-ylbenzoyl)pyridine-3-carbohydrazide?
The InChIKey is GQYYUUIZLYPXRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N4O3/c1-2-26-19-15(9-7-11-20-19)18(25)22-21-17(24)14-8-3-4-10-16(14)23-12-5-6-13-23/h3-13H,2H2,1H3,(H,21,24)(H,22,25).
What are the key properties of 2-ethoxy-N'-(2-pyrrol-1-ylbenzoyl)pyridine-3-carbohydrazide?
2-ethoxy-N'-(2-pyrrol-1-ylbenzoyl)pyridine-3-carbohydrazide has a molecular weight of 350.38 g/mol, XLogP of 2.35, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-N'-(2-pyrrol-1-ylbenzoyl)pyridine-3-carbohydrazide is sourced from PubChem (CID 24819857), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).