4-ethoxy-3-methoxy-N'-(3-propoxybenzoyl)benzohydrazide

C20H24N2O5 — CID 46490811

IUPAC4-ethoxy-3-methoxy-N'-(3-propoxybenzoyl)benzohydrazide
SMILESCCCOc1cccc(C(=O)NNC(=O)c2ccc(OCC)c(OC)c2)c1
InChIInChI=1S/C20H24N2O5/c1-4-11-27-16-8-6-7-14(12-16)19(23)21-22-20(24)15-9-10-17(26-5-2)18(13-15)25-3/h6-10,12-13H,4-5,11H2,1-3H3,(H,21,23)(H,22,24)
InChIKeyINVSPQWZAKSCON-UHFFFAOYSA-N
MW372.42 g/mol
LogP2.96
Rot. Bonds8

About 4-ethoxy-3-methoxy-N'-(3-propoxybenzoyl)benzohydrazide

4-ethoxy-3-methoxy-N'-(3-propoxybenzoyl)benzohydrazide (PubChem CID 46490811) has the molecular formula C20H24N2O5 and a molecular weight of 372.42 g/mol. Its IUPAC name is 4-ethoxy-3-methoxy-N'-(3-propoxybenzoyl)benzohydrazide.

Molecular Properties

Compound Name4-ethoxy-3-methoxy-N'-(3-propoxybenzoyl)benzohydrazide
PubChem CID46490811
Molecular FormulaC20H24N2O5
Molecular Weight372.42 g/mol
Exact Mass372.17
IUPAC Name4-ethoxy-3-methoxy-N'-(3-propoxybenzoyl)benzohydrazide
SMILESCCCOc1cccc(C(=O)NNC(=O)c2ccc(OCC)c(OC)c2)c1
InChIInChI=1S/C20H24N2O5/c1-4-11-27-16-8-6-7-14(12-16)19(23)21-22-20(24)15-9-10-17(26-5-2)18(13-15)25-3/h6-10,12-13H,4-5,11H2,1-3H3,(H,21,23)(H,22,24)
InChIKeyINVSPQWZAKSCON-UHFFFAOYSA-N
XLogP2.96
TPSA85.89 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.42
LogP ≤ 52.96
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'-(3-cyanobenzoyl)-3-methoxy-4-propoxybenzohydrazide
CID 9440251
N'-benzoyl-3-propoxybenzohydrazide
CID 4960188
N'-(3-chlorobenzoyl)-3-methoxy-4-propoxybenzohydrazide
CID 26621830
N'-(4-butoxy-3-methoxybenzoyl)-3-ethoxy-4-methoxybenzohydrazide
CID 24553442
4-chloro-2-methoxy-N'-(3-propoxybenzoyl)benzohydrazide
CID 55792202
N-[3-(4-ethoxy-3-methoxyphenyl)-1,2,4-thiadiazol-5-yl]-3-propoxybenzamide
CID 35345895
1-[(3-butoxybenzoyl)amino]-3-(3,4-dimethoxyphenyl)urea
CID 2955101
N'-benzoyl-4-butoxy-3-methoxybenzohydrazide
CID 9440054
N'-(3-ethoxypropanoyl)-3-propoxybenzohydrazide
CID 17357962
N'-(4-butoxy-3-methoxybenzoyl)-3,4,5-triethoxybenzohydrazide
CID 25442347
4-butoxy-N'-(3-cyanobenzoyl)-3-methoxybenzohydrazide
CID 9440115
N'-benzoyl-3,4-dipropoxybenzohydrazide
CID 8574890

Frequently Asked Questions

What is the IUPAC name of 4-ethoxy-3-methoxy-N'-(3-propoxybenzoyl)benzohydrazide?
The IUPAC name of 4-ethoxy-3-methoxy-N'-(3-propoxybenzoyl)benzohydrazide (CID 46490811) is 4-ethoxy-3-methoxy-N'-(3-propoxybenzoyl)benzohydrazide.
What is the SMILES notation for 4-ethoxy-3-methoxy-N'-(3-propoxybenzoyl)benzohydrazide?
The canonical SMILES for 4-ethoxy-3-methoxy-N'-(3-propoxybenzoyl)benzohydrazide is CCCOc1cccc(C(=O)NNC(=O)c2ccc(OCC)c(OC)c2)c1.
What is the InChIKey of 4-ethoxy-3-methoxy-N'-(3-propoxybenzoyl)benzohydrazide?
The InChIKey is INVSPQWZAKSCON-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O5/c1-4-11-27-16-8-6-7-14(12-16)19(23)21-22-20(24)15-9-10-17(26-5-2)18(13-15)25-3/h6-10,12-13H,4-5,11H2,1-3H3,(H,21,23)(H,22,24).
What are the key properties of 4-ethoxy-3-methoxy-N'-(3-propoxybenzoyl)benzohydrazide?
4-ethoxy-3-methoxy-N'-(3-propoxybenzoyl)benzohydrazide has a molecular weight of 372.42 g/mol, XLogP of 2.96, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethoxy-3-methoxy-N'-(3-propoxybenzoyl)benzohydrazide is sourced from PubChem (CID 46490811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).