4-pentoxy-N'-(2-phenoxyacetyl)benzohydrazide

C20H24N2O4 — CID 4935241

IUPAC4-pentoxy-N'-(2-phenoxyacetyl)benzohydrazide
SMILESCCCCCOc1ccc(C(=O)NNC(=O)COc2ccccc2)cc1
InChIInChI=1S/C20H24N2O4/c1-2-3-7-14-25-18-12-10-16(11-13-18)20(24)22-21-19(23)15-26-17-8-5-4-6-9-17/h4-6,8-13H,2-3,7,14-15H2,1H3,(H,21,23)(H,22,24)
InChIKeyURDLVKLVAMNOJK-UHFFFAOYSA-N
MW356.42 g/mol
LogP3.10
Rot. Bonds9

About 4-pentoxy-N'-(2-phenoxyacetyl)benzohydrazide

4-pentoxy-N'-(2-phenoxyacetyl)benzohydrazide (PubChem CID 4935241) has the molecular formula C20H24N2O4 and a molecular weight of 356.42 g/mol. Its IUPAC name is 4-pentoxy-N'-(2-phenoxyacetyl)benzohydrazide.

Molecular Properties

Compound Name4-pentoxy-N'-(2-phenoxyacetyl)benzohydrazide
PubChem CID4935241
Molecular FormulaC20H24N2O4
Molecular Weight356.42 g/mol
Exact Mass356.17
IUPAC Name4-pentoxy-N'-(2-phenoxyacetyl)benzohydrazide
SMILESCCCCCOc1ccc(C(=O)NNC(=O)COc2ccccc2)cc1
InChIInChI=1S/C20H24N2O4/c1-2-3-7-14-25-18-12-10-16(11-13-18)20(24)22-21-19(23)15-26-17-8-5-4-6-9-17/h4-6,8-13H,2-3,7,14-15H2,1H3,(H,21,23)(H,22,24)
InChIKeyURDLVKLVAMNOJK-UHFFFAOYSA-N
XLogP3.10
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.42
LogP ≤ 53.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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-hexoxy-N'-[4-(2-phenoxyethoxy)benzoyl]benzohydrazide
CID 4952932
N'-[2-(4-ethylphenoxy)acetyl]-4-(2-phenoxyethoxy)benzohydrazide
CID 4952907
N-[2-[2-(4-hexoxybenzoyl)hydrazinyl]-2-oxoethyl]benzamide
CID 27672476
4-hexoxy-N'-(4-oxo-4-phenylbutanoyl)benzohydrazide
CID 46423810
N'-[2-(2,6-dimethylphenoxy)acetyl]-4-heptoxybenzohydrazide
CID 4950737
N'-butanoyl-4-(2-phenoxyethoxy)benzohydrazide
CID 17340326
N'-heptanoyl-4-hexoxybenzohydrazide
CID 54789289
4-hexoxy-N'-(2-naphthalen-1-yloxyacetyl)benzohydrazide
CID 4933802
N'-(4-butoxybenzoyl)-4-phenylbenzohydrazide
CID 3096307
4-hexoxy-N'-[2-(4-nitrophenoxy)acetyl]benzohydrazide
CID 4930776
4-heptoxy-N'-[2-(4-nitrophenoxy)acetyl]benzohydrazide
CID 4950785
4-butoxy-N'-[2-(3,5-dimethylphenoxy)acetyl]benzohydrazide
CID 4936299

Frequently Asked Questions

What is the IUPAC name of 4-pentoxy-N'-(2-phenoxyacetyl)benzohydrazide?
The IUPAC name of 4-pentoxy-N'-(2-phenoxyacetyl)benzohydrazide (CID 4935241) is 4-pentoxy-N'-(2-phenoxyacetyl)benzohydrazide.
What is the SMILES notation for 4-pentoxy-N'-(2-phenoxyacetyl)benzohydrazide?
The canonical SMILES for 4-pentoxy-N'-(2-phenoxyacetyl)benzohydrazide is CCCCCOc1ccc(C(=O)NNC(=O)COc2ccccc2)cc1.
What is the InChIKey of 4-pentoxy-N'-(2-phenoxyacetyl)benzohydrazide?
The InChIKey is URDLVKLVAMNOJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O4/c1-2-3-7-14-25-18-12-10-16(11-13-18)20(24)22-21-19(23)15-26-17-8-5-4-6-9-17/h4-6,8-13H,2-3,7,14-15H2,1H3,(H,21,23)(H,22,24).
What are the key properties of 4-pentoxy-N'-(2-phenoxyacetyl)benzohydrazide?
4-pentoxy-N'-(2-phenoxyacetyl)benzohydrazide has a molecular weight of 356.42 g/mol, XLogP of 3.10, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-pentoxy-N'-(2-phenoxyacetyl)benzohydrazide is sourced from PubChem (CID 4935241), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).