4-ethoxy-N'-[4-(4-methoxyphenoxy)butanoyl]benzohydrazide

C20H24N2O5 — CID 9492733

IUPAC4-ethoxy-N'-[4-(4-methoxyphenoxy)butanoyl]benzohydrazide
SMILESCCOc1ccc(C(=O)NNC(=O)CCCOc2ccc(OC)cc2)cc1
InChIInChI=1S/C20H24N2O5/c1-3-26-17-8-6-15(7-9-17)20(24)22-21-19(23)5-4-14-27-18-12-10-16(25-2)11-13-18/h6-13H,3-5,14H2,1-2H3,(H,21,23)(H,22,24)
InChIKeyVUECJRJQSPFKDH-UHFFFAOYSA-N
MW372.42 g/mol
LogP2.71
Rot. Bonds9

About 4-ethoxy-N'-[4-(4-methoxyphenoxy)butanoyl]benzohydrazide

4-ethoxy-N'-[4-(4-methoxyphenoxy)butanoyl]benzohydrazide (PubChem CID 9492733) has the molecular formula C20H24N2O5 and a molecular weight of 372.42 g/mol. Its IUPAC name is 4-ethoxy-N'-[4-(4-methoxyphenoxy)butanoyl]benzohydrazide.

Molecular Properties

Compound Name4-ethoxy-N'-[4-(4-methoxyphenoxy)butanoyl]benzohydrazide
PubChem CID9492733
Molecular FormulaC20H24N2O5
Molecular Weight372.42 g/mol
Exact Mass372.17
IUPAC Name4-ethoxy-N'-[4-(4-methoxyphenoxy)butanoyl]benzohydrazide
SMILESCCOc1ccc(C(=O)NNC(=O)CCCOc2ccc(OC)cc2)cc1
InChIInChI=1S/C20H24N2O5/c1-3-26-17-8-6-15(7-9-17)20(24)22-21-19(23)5-4-14-27-18-12-10-16(25-2)11-13-18/h6-13H,3-5,14H2,1-2H3,(H,21,23)(H,22,24)
InChIKeyVUECJRJQSPFKDH-UHFFFAOYSA-N
XLogP2.71
TPSA85.89 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.42
LogP ≤ 52.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

4-chloro-N'-[4-(4-ethoxyphenoxy)butanoyl]benzohydrazide
CID 8014621
1-N',9-N'-bis(4-methoxybenzoyl)nonanedihydrazide
CID 3123941
N'-(4-butoxybenzoyl)-4-ethoxybenzohydrazide
CID 7979581
1-N',4-N'-bis(4-methoxybenzoyl)butanedihydrazide
CID 3140699
N'-butanoyl-4-butoxybenzohydrazide
CID 17340318
4-butoxy-N'-[2-(4-methoxyphenyl)acetyl]benzohydrazide
CID 4936338
N'-heptanoyl-4-hexoxybenzohydrazide
CID 54789289
4-(2-ethoxyethoxy)-N'-[2-(4-methoxyphenoxy)acetyl]benzohydrazide
CID 17112720
N'-[4-(4-acetylphenoxy)butanoyl]-4-methylbenzohydrazide
CID 2091478
N'-[4-(4-methoxyphenoxy)butanoyl]-1,3-benzodioxole-5-carbohydrazide
CID 9400933
N-[4-[2-(4-ethoxybenzoyl)hydrazinyl]-4-oxobutyl]benzamide
CID 39756465
ethyl 4-[2-(4-ethoxybenzoyl)hydrazinyl]-4-oxobutanoate
CID 9086442

Frequently Asked Questions

What is the IUPAC name of 4-ethoxy-N'-[4-(4-methoxyphenoxy)butanoyl]benzohydrazide?
The IUPAC name of 4-ethoxy-N'-[4-(4-methoxyphenoxy)butanoyl]benzohydrazide (CID 9492733) is 4-ethoxy-N'-[4-(4-methoxyphenoxy)butanoyl]benzohydrazide.
What is the SMILES notation for 4-ethoxy-N'-[4-(4-methoxyphenoxy)butanoyl]benzohydrazide?
The canonical SMILES for 4-ethoxy-N'-[4-(4-methoxyphenoxy)butanoyl]benzohydrazide is CCOc1ccc(C(=O)NNC(=O)CCCOc2ccc(OC)cc2)cc1.
What is the InChIKey of 4-ethoxy-N'-[4-(4-methoxyphenoxy)butanoyl]benzohydrazide?
The InChIKey is VUECJRJQSPFKDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O5/c1-3-26-17-8-6-15(7-9-17)20(24)22-21-19(23)5-4-14-27-18-12-10-16(25-2)11-13-18/h6-13H,3-5,14H2,1-2H3,(H,21,23)(H,22,24).
What are the key properties of 4-ethoxy-N'-[4-(4-methoxyphenoxy)butanoyl]benzohydrazide?
4-ethoxy-N'-[4-(4-methoxyphenoxy)butanoyl]benzohydrazide has a molecular weight of 372.42 g/mol, XLogP of 2.71, 9 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethoxy-N'-[4-(4-methoxyphenoxy)butanoyl]benzohydrazide is sourced from PubChem (CID 9492733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).