3-(furan-2-yl)-N'-(3-methoxy-4-propoxybenzoyl)-1-phenylpyrazole-5-carbohydrazide

C25H24N4O5 — CID 24583652

IUPAC3-(furan-2-yl)-N'-(3-methoxy-4-propoxybenzoyl)-1-phenylpyrazole-5-carbohydrazide
SMILESCCCOc1ccc(C(=O)NNC(=O)c2cc(-c3ccco3)nn2-c2ccccc2)cc1OC
InChIInChI=1S/C25H24N4O5/c1-3-13-33-22-12-11-17(15-23(22)32-2)24(30)26-27-25(31)20-16-19(21-10-7-14-34-21)28-29(20)18-8-5-4-6-9-18/h4-12,14-16H,3,13H2,1-2H3,(H,26,30)(H,27,31)
InChIKeyTZKDTAZOXOXVKB-UHFFFAOYSA-N
MW460.49 g/mol
LogP4.00
Rot. Bonds8

About 3-(furan-2-yl)-N'-(3-methoxy-4-propoxybenzoyl)-1-phenylpyrazole-5-carbohydrazide

3-(furan-2-yl)-N'-(3-methoxy-4-propoxybenzoyl)-1-phenylpyrazole-5-carbohydrazide (PubChem CID 24583652) has the molecular formula C25H24N4O5 and a molecular weight of 460.49 g/mol. Its IUPAC name is 3-(furan-2-yl)-N'-(3-methoxy-4-propoxybenzoyl)-1-phenylpyrazole-5-carbohydrazide.

Molecular Properties

Compound Name3-(furan-2-yl)-N'-(3-methoxy-4-propoxybenzoyl)-1-phenylpyrazole-5-carbohydrazide
PubChem CID24583652
Molecular FormulaC25H24N4O5
Molecular Weight460.49 g/mol
Exact Mass460.17
IUPAC Name3-(furan-2-yl)-N'-(3-methoxy-4-propoxybenzoyl)-1-phenylpyrazole-5-carbohydrazide
SMILESCCCOc1ccc(C(=O)NNC(=O)c2cc(-c3ccco3)nn2-c2ccccc2)cc1OC
InChIInChI=1S/C25H24N4O5/c1-3-13-33-22-12-11-17(15-23(22)32-2)24(30)26-27-25(31)20-16-19(21-10-7-14-34-21)28-29(20)18-8-5-4-6-9-18/h4-12,14-16H,3,13H2,1-2H3,(H,26,30)(H,27,31)
InChIKeyTZKDTAZOXOXVKB-UHFFFAOYSA-N
XLogP4.00
TPSA107.62 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds8
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500460.49
LogP ≤ 54.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

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Related Compounds

3-(furan-2-yl)-N'-[2-(4-methoxyanilino)acetyl]-1-phenylpyrazole-5-carbohydrazide
CID 18228202
N-[[3-(2-ethoxyethoxymethyl)phenyl]methyl]-3-(furan-2-yl)-1-phenylpyrazole-5-carboxamide
CID 55689940
N'-benzoyl-4-butoxy-3-methoxybenzohydrazide
CID 9440054
3-(furan-2-yl)-1-phenyl-N-[3-(propanoylamino)phenyl]pyrazole-5-carboxamide
CID 46569851
N'-benzoyl-3,4-dipropoxybenzohydrazide
CID 8574890
3-methoxy-N'-[2-(4-phenylphenyl)acetyl]-4-propoxybenzohydrazide
CID 25443034
N-[5-(cyclopropylsulfamoyl)-2-methoxyphenyl]-3-(furan-2-yl)-1-phenylpyrazole-5-carboxamide
CID 46535384
[3-(furan-2-yl)-1-phenylpyrazol-5-yl]-[4-(4-methoxyphenyl)piperazin-1-yl]methanone
CID 18266915
3-(furan-2-yl)-1-(3-methoxyphenyl)pyrazole-5-carboxylic acid
CID 82370914
N'-(3-methoxy-4-propoxybenzoyl)-2-methylquinoline-4-carbohydrazide
CID 26621803
[2-(butylamino)-2-oxoethyl] 3-(furan-2-yl)-1-phenylpyrazole-5-carboxylate
CID 55491371
N'-(4-butoxy-3-methoxybenzoyl)-3-phenyl-2-sulfanylidene-1H-imidazole-4-carbohydrazide
CID 24553487

Frequently Asked Questions

What is the IUPAC name of 3-(furan-2-yl)-N'-(3-methoxy-4-propoxybenzoyl)-1-phenylpyrazole-5-carbohydrazide?
The IUPAC name of 3-(furan-2-yl)-N'-(3-methoxy-4-propoxybenzoyl)-1-phenylpyrazole-5-carbohydrazide (CID 24583652) is 3-(furan-2-yl)-N'-(3-methoxy-4-propoxybenzoyl)-1-phenylpyrazole-5-carbohydrazide.
What is the SMILES notation for 3-(furan-2-yl)-N'-(3-methoxy-4-propoxybenzoyl)-1-phenylpyrazole-5-carbohydrazide?
The canonical SMILES for 3-(furan-2-yl)-N'-(3-methoxy-4-propoxybenzoyl)-1-phenylpyrazole-5-carbohydrazide is CCCOc1ccc(C(=O)NNC(=O)c2cc(-c3ccco3)nn2-c2ccccc2)cc1OC.
What is the InChIKey of 3-(furan-2-yl)-N'-(3-methoxy-4-propoxybenzoyl)-1-phenylpyrazole-5-carbohydrazide?
The InChIKey is TZKDTAZOXOXVKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H24N4O5/c1-3-13-33-22-12-11-17(15-23(22)32-2)24(30)26-27-25(31)20-16-19(21-10-7-14-34-21)28-29(20)18-8-5-4-6-9-18/h4-12,14-16H,3,13H2,1-2H3,(H,26,30)(H,27,31).
What are the key properties of 3-(furan-2-yl)-N'-(3-methoxy-4-propoxybenzoyl)-1-phenylpyrazole-5-carbohydrazide?
3-(furan-2-yl)-N'-(3-methoxy-4-propoxybenzoyl)-1-phenylpyrazole-5-carbohydrazide has a molecular weight of 460.49 g/mol, XLogP of 4.00, 8 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(furan-2-yl)-N'-(3-methoxy-4-propoxybenzoyl)-1-phenylpyrazole-5-carbohydrazide is sourced from PubChem (CID 24583652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).