N'-[2-(3-methoxyphenoxy)acetyl]pyridine-3-carbohydrazide

C15H15N3O4 — CID 17386186

IUPACN'-[2-(3-methoxyphenoxy)acetyl]pyridine-3-carbohydrazide
SMILESCOc1cccc(OCC(=O)NNC(=O)c2cccnc2)c1
InChIInChI=1S/C15H15N3O4/c1-21-12-5-2-6-13(8-12)22-10-14(19)17-18-15(20)11-4-3-7-16-9-11/h2-9H,10H2,1H3,(H,17,19)(H,18,20)
InChIKeyJXCXBDIWTBGZAF-UHFFFAOYSA-N
MW301.30 g/mol
LogP0.93
Rot. Bonds5

About N'-[2-(3-methoxyphenoxy)acetyl]pyridine-3-carbohydrazide

N'-[2-(3-methoxyphenoxy)acetyl]pyridine-3-carbohydrazide (PubChem CID 17386186) has the molecular formula C15H15N3O4 and a molecular weight of 301.30 g/mol. Its IUPAC name is N'-[2-(3-methoxyphenoxy)acetyl]pyridine-3-carbohydrazide.

Molecular Properties

Compound NameN'-[2-(3-methoxyphenoxy)acetyl]pyridine-3-carbohydrazide
PubChem CID17386186
Molecular FormulaC15H15N3O4
Molecular Weight301.30 g/mol
Exact Mass301.11
IUPAC NameN'-[2-(3-methoxyphenoxy)acetyl]pyridine-3-carbohydrazide
SMILESCOc1cccc(OCC(=O)NNC(=O)c2cccnc2)c1
InChIInChI=1S/C15H15N3O4/c1-21-12-5-2-6-13(8-12)22-10-14(19)17-18-15(20)11-4-3-7-16-9-11/h2-9H,10H2,1H3,(H,17,19)(H,18,20)
InChIKeyJXCXBDIWTBGZAF-UHFFFAOYSA-N
XLogP0.93
TPSA89.55 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.30
LogP ≤ 50.93
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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Related Compounds

N'-[2-(4-methylphenoxy)acetyl]pyridine-3-carbohydrazide
CID 839627
N'-[2-(4-fluorophenoxy)acetyl]-3-methoxybenzohydrazide
CID 8880066
N'-[2-(3-bromophenoxy)acetyl]-3,5-dimethoxybenzohydrazide
CID 7921241
N'-[2-(4-bromo-3-methylphenoxy)acetyl]-3-methoxybenzohydrazide
CID 3117674
N'-[(E)-3-(3-methoxyphenyl)prop-2-enoyl]pyridine-3-carbohydrazide
CID 26641259
3-methoxy-N'-[2-(2-methoxyphenoxy)acetyl]benzohydrazide
CID 7720061
1-(3-methoxyphenyl)-3-pyridin-3-ylpropane-1,3-dione
CID 43321352
N'-[2-(3,4,5-trimethoxyphenyl)acetyl]pyridine-3-carbohydrazide
CID 46651699
2-(3-methoxyphenoxy)-N-[(E)-pyridin-3-ylmethylideneamino]acetamide
CID 19208665
3-methyl-N'-[2-(3-methylphenoxy)acetyl]benzohydrazide
CID 732321
N'-[3-[(3-methylphenyl)methoxy]benzoyl]pyridine-3-carbohydrazide
CID 35153545
N'-[2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetyl]pyridine-3-carbohydrazide
CID 35015838

Frequently Asked Questions

What is the IUPAC name of N'-[2-(3-methoxyphenoxy)acetyl]pyridine-3-carbohydrazide?
The IUPAC name of N'-[2-(3-methoxyphenoxy)acetyl]pyridine-3-carbohydrazide (CID 17386186) is N'-[2-(3-methoxyphenoxy)acetyl]pyridine-3-carbohydrazide.
What is the SMILES notation for N'-[2-(3-methoxyphenoxy)acetyl]pyridine-3-carbohydrazide?
The canonical SMILES for N'-[2-(3-methoxyphenoxy)acetyl]pyridine-3-carbohydrazide is COc1cccc(OCC(=O)NNC(=O)c2cccnc2)c1.
What is the InChIKey of N'-[2-(3-methoxyphenoxy)acetyl]pyridine-3-carbohydrazide?
The InChIKey is JXCXBDIWTBGZAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3O4/c1-21-12-5-2-6-13(8-12)22-10-14(19)17-18-15(20)11-4-3-7-16-9-11/h2-9H,10H2,1H3,(H,17,19)(H,18,20).
What are the key properties of N'-[2-(3-methoxyphenoxy)acetyl]pyridine-3-carbohydrazide?
N'-[2-(3-methoxyphenoxy)acetyl]pyridine-3-carbohydrazide has a molecular weight of 301.30 g/mol, XLogP of 0.93, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[2-(3-methoxyphenoxy)acetyl]pyridine-3-carbohydrazide is sourced from PubChem (CID 17386186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).