N'-[2-(4-methoxyphenyl)acetyl]pyridine-2-carbohydrazide

C15H15N3O3 — CID 5099490

IUPACN'-[2-(4-methoxyphenyl)acetyl]pyridine-2-carbohydrazide
SMILESCOc1ccc(CC(=O)NNC(=O)c2ccccn2)cc1
InChIInChI=1S/C15H15N3O3/c1-21-12-7-5-11(6-8-12)10-14(19)17-18-15(20)13-4-2-3-9-16-13/h2-9H,10H2,1H3,(H,17,19)(H,18,20)
InChIKeyZOHJPRDYWWCFSO-UHFFFAOYSA-N
MW285.30 g/mol
LogP1.09
Rot. Bonds4

About N'-[2-(4-methoxyphenyl)acetyl]pyridine-2-carbohydrazide

N'-[2-(4-methoxyphenyl)acetyl]pyridine-2-carbohydrazide (PubChem CID 5099490) has the molecular formula C15H15N3O3 and a molecular weight of 285.30 g/mol. Its IUPAC name is N'-[2-(4-methoxyphenyl)acetyl]pyridine-2-carbohydrazide.

Molecular Properties

Compound NameN'-[2-(4-methoxyphenyl)acetyl]pyridine-2-carbohydrazide
PubChem CID5099490
Molecular FormulaC15H15N3O3
Molecular Weight285.30 g/mol
Exact Mass285.11
IUPAC NameN'-[2-(4-methoxyphenyl)acetyl]pyridine-2-carbohydrazide
SMILESCOc1ccc(CC(=O)NNC(=O)c2ccccn2)cc1
InChIInChI=1S/C15H15N3O3/c1-21-12-7-5-11(6-8-12)10-14(19)17-18-15(20)13-4-2-3-9-16-13/h2-9H,10H2,1H3,(H,17,19)(H,18,20)
InChIKeyZOHJPRDYWWCFSO-UHFFFAOYSA-N
XLogP1.09
TPSA80.32 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.30
LogP ≤ 51.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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 N'-[2-(4-methoxyphenyl)acetyl]pyridine-2-carbohydrazide?
The IUPAC name of N'-[2-(4-methoxyphenyl)acetyl]pyridine-2-carbohydrazide (CID 5099490) is N'-[2-(4-methoxyphenyl)acetyl]pyridine-2-carbohydrazide.
What is the SMILES notation for N'-[2-(4-methoxyphenyl)acetyl]pyridine-2-carbohydrazide?
The canonical SMILES for N'-[2-(4-methoxyphenyl)acetyl]pyridine-2-carbohydrazide is COc1ccc(CC(=O)NNC(=O)c2ccccn2)cc1.
What is the InChIKey of N'-[2-(4-methoxyphenyl)acetyl]pyridine-2-carbohydrazide?
The InChIKey is ZOHJPRDYWWCFSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3O3/c1-21-12-7-5-11(6-8-12)10-14(19)17-18-15(20)13-4-2-3-9-16-13/h2-9H,10H2,1H3,(H,17,19)(H,18,20).
What are the key properties of N'-[2-(4-methoxyphenyl)acetyl]pyridine-2-carbohydrazide?
N'-[2-(4-methoxyphenyl)acetyl]pyridine-2-carbohydrazide has a molecular weight of 285.30 g/mol, XLogP of 1.09, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[2-(4-methoxyphenyl)acetyl]pyridine-2-carbohydrazide is sourced from PubChem (CID 5099490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).