5-(4-chlorophenyl)-N'-[2-(3-methylphenoxy)acetyl]furan-2-carbohydrazide

C20H17ClN2O4 — CID 24502806

IUPAC5-(4-chlorophenyl)-N'-[2-(3-methylphenoxy)acetyl]furan-2-carbohydrazide
SMILESCc1cccc(OCC(=O)NNC(=O)c2ccc(-c3ccc(Cl)cc3)o2)c1
InChIInChI=1S/C20H17ClN2O4/c1-13-3-2-4-16(11-13)26-12-19(24)22-23-20(25)18-10-9-17(27-18)14-5-7-15(21)8-6-14/h2-11H,12H2,1H3,(H,22,24)(H,23,25)
InChIKeyMWNYNGXCHMJFGH-UHFFFAOYSA-N
MW384.82 g/mol
LogP3.75
Rot. Bonds5

About 5-(4-chlorophenyl)-N'-[2-(3-methylphenoxy)acetyl]furan-2-carbohydrazide

5-(4-chlorophenyl)-N'-[2-(3-methylphenoxy)acetyl]furan-2-carbohydrazide (PubChem CID 24502806) has the molecular formula C20H17ClN2O4 and a molecular weight of 384.82 g/mol. Its IUPAC name is 5-(4-chlorophenyl)-N'-[2-(3-methylphenoxy)acetyl]furan-2-carbohydrazide.

Molecular Properties

Compound Name5-(4-chlorophenyl)-N'-[2-(3-methylphenoxy)acetyl]furan-2-carbohydrazide
PubChem CID24502806
Molecular FormulaC20H17ClN2O4
Molecular Weight384.82 g/mol
Exact Mass384.09
IUPAC Name5-(4-chlorophenyl)-N'-[2-(3-methylphenoxy)acetyl]furan-2-carbohydrazide
SMILESCc1cccc(OCC(=O)NNC(=O)c2ccc(-c3ccc(Cl)cc3)o2)c1
InChIInChI=1S/C20H17ClN2O4/c1-13-3-2-4-16(11-13)26-12-19(24)22-23-20(25)18-10-9-17(27-18)14-5-7-15(21)8-6-14/h2-11H,12H2,1H3,(H,22,24)(H,23,25)
InChIKeyMWNYNGXCHMJFGH-UHFFFAOYSA-N
XLogP3.75
TPSA80.57 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.82
LogP ≤ 53.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-(4-chlorophenyl)-N-[[[2-(3-methylphenoxy)acetyl]amino]carbamothioyl]acetamide
CID 4937121
5-(4-chlorophenyl)-N-[[(2-phenoxyacetyl)amino]carbamothioyl]furan-2-carboxamide
CID 10884485
N'-[2-(4-chlorophenoxy)acetyl]-3-methylbenzohydrazide
CID 732324
N'-[2-(3-methylphenoxy)acetyl]-3-(5-phenylfuran-2-yl)propanehydrazide
CID 35767998
3-methyl-N'-[2-(3-methylphenoxy)acetyl]benzohydrazide
CID 732321
N'-[2-(2,5-dichlorophenoxy)acetyl]-2-(3-methylphenoxy)acetohydrazide
CID 19167991
methyl 3-[2-[2-(3-methylphenoxy)acetyl]hydrazinyl]-3-oxopropanoate
CID 28638195
1-[[5-(4-chlorophenyl)furan-2-carbonyl]amino]-3-(2,5-dimethylphenyl)thiourea
CID 18871754
N-[(1R)-1-(4-chlorophenyl)ethyl]-2-(3-methylphenoxy)acetamide
CID 8751664
N'-[2-(3-methylphenoxy)acetyl]furan-3-carbohydrazide
CID 51264727
2-(3,4-dimethoxyphenyl)-N'-[2-(3-methylphenoxy)acetyl]acetohydrazide
CID 7808998
N'-[2-(4-chlorophenyl)acetyl]-3-methylbenzohydrazide
CID 965991

Frequently Asked Questions

What is the IUPAC name of 5-(4-chlorophenyl)-N'-[2-(3-methylphenoxy)acetyl]furan-2-carbohydrazide?
The IUPAC name of 5-(4-chlorophenyl)-N'-[2-(3-methylphenoxy)acetyl]furan-2-carbohydrazide (CID 24502806) is 5-(4-chlorophenyl)-N'-[2-(3-methylphenoxy)acetyl]furan-2-carbohydrazide.
What is the SMILES notation for 5-(4-chlorophenyl)-N'-[2-(3-methylphenoxy)acetyl]furan-2-carbohydrazide?
The canonical SMILES for 5-(4-chlorophenyl)-N'-[2-(3-methylphenoxy)acetyl]furan-2-carbohydrazide is Cc1cccc(OCC(=O)NNC(=O)c2ccc(-c3ccc(Cl)cc3)o2)c1.
What is the InChIKey of 5-(4-chlorophenyl)-N'-[2-(3-methylphenoxy)acetyl]furan-2-carbohydrazide?
The InChIKey is MWNYNGXCHMJFGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17ClN2O4/c1-13-3-2-4-16(11-13)26-12-19(24)22-23-20(25)18-10-9-17(27-18)14-5-7-15(21)8-6-14/h2-11H,12H2,1H3,(H,22,24)(H,23,25).
What are the key properties of 5-(4-chlorophenyl)-N'-[2-(3-methylphenoxy)acetyl]furan-2-carbohydrazide?
5-(4-chlorophenyl)-N'-[2-(3-methylphenoxy)acetyl]furan-2-carbohydrazide has a molecular weight of 384.82 g/mol, XLogP of 3.75, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-chlorophenyl)-N'-[2-(3-methylphenoxy)acetyl]furan-2-carbohydrazide is sourced from PubChem (CID 24502806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).