3-methoxy-N'-[2-(3-methylphenoxy)acetyl]-4-prop-2-enoxybenzohydrazide

C20H22N2O5 — CID 24538794

IUPAC3-methoxy-N'-[2-(3-methylphenoxy)acetyl]-4-prop-2-enoxybenzohydrazide
SMILESC=CCOc1ccc(C(=O)NNC(=O)COc2cccc(C)c2)cc1OC
InChIInChI=1S/C20H22N2O5/c1-4-10-26-17-9-8-15(12-18(17)25-3)20(24)22-21-19(23)13-27-16-7-5-6-14(2)11-16/h4-9,11-12H,1,10,13H2,2-3H3,(H,21,23)(H,22,24)
InChIKeyPRVLYDVMPYKBCF-UHFFFAOYSA-N
MW370.41 g/mol
LogP2.41
Rot. Bonds8

About 3-methoxy-N'-[2-(3-methylphenoxy)acetyl]-4-prop-2-enoxybenzohydrazide

3-methoxy-N'-[2-(3-methylphenoxy)acetyl]-4-prop-2-enoxybenzohydrazide (PubChem CID 24538794) has the molecular formula C20H22N2O5 and a molecular weight of 370.41 g/mol. Its IUPAC name is 3-methoxy-N'-[2-(3-methylphenoxy)acetyl]-4-prop-2-enoxybenzohydrazide.

Molecular Properties

Compound Name3-methoxy-N'-[2-(3-methylphenoxy)acetyl]-4-prop-2-enoxybenzohydrazide
PubChem CID24538794
Molecular FormulaC20H22N2O5
Molecular Weight370.41 g/mol
Exact Mass370.15
IUPAC Name3-methoxy-N'-[2-(3-methylphenoxy)acetyl]-4-prop-2-enoxybenzohydrazide
SMILESC=CCOc1ccc(C(=O)NNC(=O)COc2cccc(C)c2)cc1OC
InChIInChI=1S/C20H22N2O5/c1-4-10-26-17-9-8-15(12-18(17)25-3)20(24)22-21-19(23)13-27-16-7-5-6-14(2)11-16/h4-9,11-12H,1,10,13H2,2-3H3,(H,21,23)(H,22,24)
InChIKeyPRVLYDVMPYKBCF-UHFFFAOYSA-N
XLogP2.41
TPSA85.89 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.41
LogP ≤ 52.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze 3-methoxy-N'-[2-(3-methylphenoxy)acetyl]-4-prop-2-enoxybenzohydrazide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-methyl-N'-[2-(3-methylphenoxy)acetyl]benzohydrazide
CID 732321
2-(3,4-dimethoxyphenyl)-N'-[2-(3-methylphenoxy)acetyl]acetohydrazide
CID 7808998
2-methoxy-N-(2-methoxyethyl)-5-[[[2-(3-methylphenoxy)acetyl]amino]carbamoyl]benzenesulfonamide
CID 24538797
3-ethoxy-N'-[2-(3-methylphenoxy)acetyl]-4-(2-methylpropoxy)benzohydrazide
CID 24538750
4-benzoyl-N'-[2-(3-methylphenoxy)acetyl]benzohydrazide
CID 7601018
3-methoxy-N-(3-methoxyphenyl)-4-prop-2-enoxybenzamide
CID 27167629
N'-[2-(3-methylphenoxy)acetyl]-3-(2-phenoxyethoxy)benzohydrazide
CID 4955104
N'-(3-methoxy-4-prop-2-enoxybenzoyl)-1H-pyrrole-2-carbohydrazide
CID 78829676
N'-[2-(4-methylphenoxy)acetyl]-4-prop-2-enoxybenzohydrazide
CID 4925883
3-bromo-N'-[2-(3,5-dimethylphenoxy)acetyl]-4-methoxybenzohydrazide
CID 4501311
N-[(E)-[3-(2-amino-2-oxoethoxy)phenyl]methylideneamino]-3-methoxy-4-prop-2-enoxybenzamide
CID 126324774
3-methyl-N'-[2-(3-methylphenoxy)acetyl]-4-nitrobenzohydrazide
CID 7943194

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-N'-[2-(3-methylphenoxy)acetyl]-4-prop-2-enoxybenzohydrazide?
The IUPAC name of 3-methoxy-N'-[2-(3-methylphenoxy)acetyl]-4-prop-2-enoxybenzohydrazide (CID 24538794) is 3-methoxy-N'-[2-(3-methylphenoxy)acetyl]-4-prop-2-enoxybenzohydrazide.
What is the SMILES notation for 3-methoxy-N'-[2-(3-methylphenoxy)acetyl]-4-prop-2-enoxybenzohydrazide?
The canonical SMILES for 3-methoxy-N'-[2-(3-methylphenoxy)acetyl]-4-prop-2-enoxybenzohydrazide is C=CCOc1ccc(C(=O)NNC(=O)COc2cccc(C)c2)cc1OC.
What is the InChIKey of 3-methoxy-N'-[2-(3-methylphenoxy)acetyl]-4-prop-2-enoxybenzohydrazide?
The InChIKey is PRVLYDVMPYKBCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N2O5/c1-4-10-26-17-9-8-15(12-18(17)25-3)20(24)22-21-19(23)13-27-16-7-5-6-14(2)11-16/h4-9,11-12H,1,10,13H2,2-3H3,(H,21,23)(H,22,24).
What are the key properties of 3-methoxy-N'-[2-(3-methylphenoxy)acetyl]-4-prop-2-enoxybenzohydrazide?
3-methoxy-N'-[2-(3-methylphenoxy)acetyl]-4-prop-2-enoxybenzohydrazide has a molecular weight of 370.41 g/mol, XLogP of 2.41, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-N'-[2-(3-methylphenoxy)acetyl]-4-prop-2-enoxybenzohydrazide is sourced from PubChem (CID 24538794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).