N'-[(E)-3-(3-methoxy-4-prop-2-enoxyphenyl)prop-2-enoyl]furan-2-carbohydrazide

C18H18N2O5 — CID 9476514

IUPACN'-[(E)-3-(3-methoxy-4-prop-2-enoxyphenyl)prop-2-enoyl]furan-2-carbohydrazide
SMILESC=CCOc1ccc(/C=C/C(=O)NNC(=O)c2ccco2)cc1OC
InChIInChI=1S/C18H18N2O5/c1-3-10-24-14-8-6-13(12-16(14)23-2)7-9-17(21)19-20-18(22)15-5-4-11-25-15/h3-9,11-12H,1,10H2,2H3,(H,19,21)(H,20,22)/b9-7+
InChIKeyFHVILXZFQIRVSF-VQHVLOKHSA-N
MW342.35 g/mol
LogP2.33
Rot. Bonds7

About N'-[(E)-3-(3-methoxy-4-prop-2-enoxyphenyl)prop-2-enoyl]furan-2-carbohydrazide

N'-[(E)-3-(3-methoxy-4-prop-2-enoxyphenyl)prop-2-enoyl]furan-2-carbohydrazide (PubChem CID 9476514) has the molecular formula C18H18N2O5 and a molecular weight of 342.35 g/mol. Its IUPAC name is N'-[(E)-3-(3-methoxy-4-prop-2-enoxyphenyl)prop-2-enoyl]furan-2-carbohydrazide.

Molecular Properties

Compound NameN'-[(E)-3-(3-methoxy-4-prop-2-enoxyphenyl)prop-2-enoyl]furan-2-carbohydrazide
PubChem CID9476514
Molecular FormulaC18H18N2O5
Molecular Weight342.35 g/mol
Exact Mass342.12
IUPAC NameN'-[(E)-3-(3-methoxy-4-prop-2-enoxyphenyl)prop-2-enoyl]furan-2-carbohydrazide
SMILESC=CCOc1ccc(/C=C/C(=O)NNC(=O)c2ccco2)cc1OC
InChIInChI=1S/C18H18N2O5/c1-3-10-24-14-8-6-13(12-16(14)23-2)7-9-17(21)19-20-18(22)15-5-4-11-25-15/h3-9,11-12H,1,10H2,2H3,(H,19,21)(H,20,22)/b9-7+
InChIKeyFHVILXZFQIRVSF-VQHVLOKHSA-N
XLogP2.33
TPSA89.80 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.35
LogP ≤ 52.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze N'-[(E)-3-(3-methoxy-4-prop-2-enoxyphenyl)prop-2-enoyl]furan-2-carbohydrazide 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

N'-[(E)-3-(3-methoxy-4-prop-2-enoxyphenyl)prop-2-enoyl]-2,5-dimethylfuran-3-carbohydrazide
CID 9468098
N'-[(E)-3-(3,4-dimethoxyphenyl)prop-2-enoyl]-4-prop-2-enoxybenzohydrazide
CID 6232483
[2-[2-(furan-2-carbonyl)hydrazinyl]-2-oxoethyl] 2-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]acetate
CID 8527703
(E)-N-(2-hydroxyethyl)-3-(3-methoxy-4-prop-2-enoxyphenyl)prop-2-enamide
CID 78783486
N-[4-[(3-methoxy-4-prop-2-enoxybenzoyl)amino]phenyl]furan-2-carboxamide
CID 42014838
(E)-N-(3-acetamidophenyl)-3-(3-methoxy-4-prop-2-enoxyphenyl)prop-2-enamide
CID 26103193
1-(4-fluorophenyl)-3-[[(E)-3-(3-methoxy-4-prop-2-enoxyphenyl)prop-2-enoyl]amino]thiourea
CID 9469345
(E)-3-(3,4-dimethoxyphenyl)-N-[[(2-prop-2-enoxybenzoyl)amino]carbamothioyl]prop-2-enamide
CID 6233416
(E)-N-(3,5-dimethoxyphenyl)-3-(3-methoxy-4-prop-2-enoxyphenyl)prop-2-enamide
CID 9096622
(E)-N-(3-methoxyphenyl)-3-(3-methoxy-4-prop-2-enoxyphenyl)prop-2-enamide
CID 26914384
N-[(4-bromophenyl)methyl]-3-(3-methoxy-4-prop-2-enoxyphenyl)prop-2-enamide
CID 72688828
3-(3-methoxy-4-prop-2-enoxyphenyl)-1-phenylprop-2-en-1-one
CID 75849735

Frequently Asked Questions

What is the IUPAC name of N'-[(E)-3-(3-methoxy-4-prop-2-enoxyphenyl)prop-2-enoyl]furan-2-carbohydrazide?
The IUPAC name of N'-[(E)-3-(3-methoxy-4-prop-2-enoxyphenyl)prop-2-enoyl]furan-2-carbohydrazide (CID 9476514) is N'-[(E)-3-(3-methoxy-4-prop-2-enoxyphenyl)prop-2-enoyl]furan-2-carbohydrazide.
What is the SMILES notation for N'-[(E)-3-(3-methoxy-4-prop-2-enoxyphenyl)prop-2-enoyl]furan-2-carbohydrazide?
The canonical SMILES for N'-[(E)-3-(3-methoxy-4-prop-2-enoxyphenyl)prop-2-enoyl]furan-2-carbohydrazide is C=CCOc1ccc(/C=C/C(=O)NNC(=O)c2ccco2)cc1OC.
What is the InChIKey of N'-[(E)-3-(3-methoxy-4-prop-2-enoxyphenyl)prop-2-enoyl]furan-2-carbohydrazide?
The InChIKey is FHVILXZFQIRVSF-VQHVLOKHSA-N. The full InChI is InChI=1S/C18H18N2O5/c1-3-10-24-14-8-6-13(12-16(14)23-2)7-9-17(21)19-20-18(22)15-5-4-11-25-15/h3-9,11-12H,1,10H2,2H3,(H,19,21)(H,20,22)/b9-7+.
What are the key properties of N'-[(E)-3-(3-methoxy-4-prop-2-enoxyphenyl)prop-2-enoyl]furan-2-carbohydrazide?
N'-[(E)-3-(3-methoxy-4-prop-2-enoxyphenyl)prop-2-enoyl]furan-2-carbohydrazide has a molecular weight of 342.35 g/mol, XLogP of 2.33, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[(E)-3-(3-methoxy-4-prop-2-enoxyphenyl)prop-2-enoyl]furan-2-carbohydrazide is sourced from PubChem (CID 9476514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).