2-methyl-N'-(3-phenoxybenzoyl)furan-3-carbohydrazide

C19H16N2O4 — CID 7809073

IUPAC2-methyl-N'-(3-phenoxybenzoyl)furan-3-carbohydrazide
SMILESCc1occc1C(=O)NNC(=O)c1cccc(Oc2ccccc2)c1
InChIInChI=1S/C19H16N2O4/c1-13-17(10-11-24-13)19(23)21-20-18(22)14-6-5-9-16(12-14)25-15-7-3-2-4-8-15/h2-12H,1H3,(H,20,22)(H,21,23)
InChIKeyBPDHPMXLGVUJLE-UHFFFAOYSA-N
MW336.35 g/mol
LogP3.46
Rot. Bonds4

About 2-methyl-N'-(3-phenoxybenzoyl)furan-3-carbohydrazide

2-methyl-N'-(3-phenoxybenzoyl)furan-3-carbohydrazide (PubChem CID 7809073) has the molecular formula C19H16N2O4 and a molecular weight of 336.35 g/mol. Its IUPAC name is 2-methyl-N'-(3-phenoxybenzoyl)furan-3-carbohydrazide.

Molecular Properties

Compound Name2-methyl-N'-(3-phenoxybenzoyl)furan-3-carbohydrazide
PubChem CID7809073
Molecular FormulaC19H16N2O4
Molecular Weight336.35 g/mol
Exact Mass336.11
IUPAC Name2-methyl-N'-(3-phenoxybenzoyl)furan-3-carbohydrazide
SMILESCc1occc1C(=O)NNC(=O)c1cccc(Oc2ccccc2)c1
InChIInChI=1S/C19H16N2O4/c1-13-17(10-11-24-13)19(23)21-20-18(22)14-6-5-9-16(12-14)25-15-7-3-2-4-8-15/h2-12H,1H3,(H,20,22)(H,21,23)
InChIKeyBPDHPMXLGVUJLE-UHFFFAOYSA-N
XLogP3.46
TPSA80.57 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.35
LogP ≤ 53.46
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

1-N',4-N'-bis(2-methylfuran-3-carbonyl)benzene-1,4-dicarbohydrazide
CID 1011836
2-methyl-N'-[3-(trifluoromethyl)benzoyl]furan-3-carbohydrazide
CID 27171508
N'-(3-methoxy-4-phenylmethoxybenzoyl)-2-methylfuran-3-carbohydrazide
CID 9472683
N-(2-methylphenyl)-3-phenoxybenzamide
CID 2097138
2-methyl-N'-[2-(3-methylphenoxy)propanoyl]furan-3-carbohydrazide
CID 18104346
2-methyl-N'-[2-[4-(4-methylphenoxy)phenoxy]acetyl]furan-3-carbohydrazide
CID 24633129
[2-[2-(furan-2-carbonyl)hydrazinyl]-2-oxoethyl] 3-phenoxybenzoate
CID 7985162
N-(4-acetamidophenyl)-3-phenoxybenzamide
CID 2483771
4-[4-(benzamidocarbamoyl)phenoxy]-N'-benzoylbenzohydrazide
CID 21231530
2-methyl-N'-(3-propan-2-yloxybenzoyl)benzohydrazide
CID 17142532
2-methyl-N'-(3-phenylmethoxybenzoyl)benzohydrazide
CID 46520493
N-(3-acetylphenyl)-2-methylfuran-3-carboxamide
CID 896770

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N'-(3-phenoxybenzoyl)furan-3-carbohydrazide?
The IUPAC name of 2-methyl-N'-(3-phenoxybenzoyl)furan-3-carbohydrazide (CID 7809073) is 2-methyl-N'-(3-phenoxybenzoyl)furan-3-carbohydrazide.
What is the SMILES notation for 2-methyl-N'-(3-phenoxybenzoyl)furan-3-carbohydrazide?
The canonical SMILES for 2-methyl-N'-(3-phenoxybenzoyl)furan-3-carbohydrazide is Cc1occc1C(=O)NNC(=O)c1cccc(Oc2ccccc2)c1.
What is the InChIKey of 2-methyl-N'-(3-phenoxybenzoyl)furan-3-carbohydrazide?
The InChIKey is BPDHPMXLGVUJLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N2O4/c1-13-17(10-11-24-13)19(23)21-20-18(22)14-6-5-9-16(12-14)25-15-7-3-2-4-8-15/h2-12H,1H3,(H,20,22)(H,21,23).
What are the key properties of 2-methyl-N'-(3-phenoxybenzoyl)furan-3-carbohydrazide?
2-methyl-N'-(3-phenoxybenzoyl)furan-3-carbohydrazide has a molecular weight of 336.35 g/mol, XLogP of 3.46, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N'-(3-phenoxybenzoyl)furan-3-carbohydrazide is sourced from PubChem (CID 7809073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).