N'-(2-fluorobenzoyl)-5-(phenoxymethyl)furan-2-carbohydrazide

C19H15FN2O4 — CID 4795196

IUPACN'-(2-fluorobenzoyl)-5-(phenoxymethyl)furan-2-carbohydrazide
SMILESO=C(NNC(=O)c1ccccc1F)c1ccc(COc2ccccc2)o1
InChIInChI=1S/C19H15FN2O4/c20-16-9-5-4-8-15(16)18(23)21-22-19(24)17-11-10-14(26-17)12-25-13-6-2-1-3-7-13/h1-11H,12H2,(H,21,23)(H,22,24)
InChIKeyJLDDNBFMANWJDQ-UHFFFAOYSA-N
MW354.34 g/mol
LogP3.07
Rot. Bonds5

About N'-(2-fluorobenzoyl)-5-(phenoxymethyl)furan-2-carbohydrazide

N'-(2-fluorobenzoyl)-5-(phenoxymethyl)furan-2-carbohydrazide (PubChem CID 4795196) has the molecular formula C19H15FN2O4 and a molecular weight of 354.34 g/mol. Its IUPAC name is N'-(2-fluorobenzoyl)-5-(phenoxymethyl)furan-2-carbohydrazide.

Molecular Properties

Compound NameN'-(2-fluorobenzoyl)-5-(phenoxymethyl)furan-2-carbohydrazide
PubChem CID4795196
Molecular FormulaC19H15FN2O4
Molecular Weight354.34 g/mol
Exact Mass354.10
IUPAC NameN'-(2-fluorobenzoyl)-5-(phenoxymethyl)furan-2-carbohydrazide
SMILESO=C(NNC(=O)c1ccccc1F)c1ccc(COc2ccccc2)o1
InChIInChI=1S/C19H15FN2O4/c20-16-9-5-4-8-15(16)18(23)21-22-19(24)17-11-10-14(26-17)12-25-13-6-2-1-3-7-13/h1-11H,12H2,(H,21,23)(H,22,24)
InChIKeyJLDDNBFMANWJDQ-UHFFFAOYSA-N
XLogP3.07
TPSA80.57 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.34
LogP ≤ 53.07
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

N'-(2,4-dichloro-5-fluorobenzoyl)-5-(phenoxymethyl)furan-2-carbohydrazide
CID 46656994
2-fluoro-N'-[4-(phenoxymethyl)benzoyl]benzohydrazide
CID 4875820
N'-benzoyl-5-[(4-fluorophenoxy)methyl]furan-2-carbohydrazide
CID 27555711
2-(difluoromethylsulfanyl)-N'-[5-(phenoxymethyl)furan-2-carbonyl]pyridine-3-carbohydrazide
CID 24553921
N'-[2-(4-chlorophenyl)acetyl]-5-(phenoxymethyl)furan-2-carbohydrazide
CID 9219836
N-methyl-5-(phenoxymethyl)furan-2-carboxamide
CID 7678218
N'-[2-(4-hydroxyphenyl)acetyl]-5-(phenoxymethyl)furan-2-carbohydrazide
CID 78822023
N'-(2-methoxyacetyl)-5-(phenoxymethyl)furan-2-carbohydrazide
CID 31466053
N-(3-carbamoyl-4-fluorophenyl)-5-(phenoxymethyl)furan-2-carboxamide
CID 39213699
N'-(4-methylbenzoyl)-5-(phenoxymethyl)furan-2-carbohydrazide
CID 7979169
N-[(4-fluorophenyl)methyl]-5-(phenoxymethyl)furan-2-carboxamide
CID 7975174
N'-(4-phenoxybutanoyl)-5-(phenoxymethyl)furan-2-carbohydrazide
CID 31837131

Frequently Asked Questions

What is the IUPAC name of N'-(2-fluorobenzoyl)-5-(phenoxymethyl)furan-2-carbohydrazide?
The IUPAC name of N'-(2-fluorobenzoyl)-5-(phenoxymethyl)furan-2-carbohydrazide (CID 4795196) is N'-(2-fluorobenzoyl)-5-(phenoxymethyl)furan-2-carbohydrazide.
What is the SMILES notation for N'-(2-fluorobenzoyl)-5-(phenoxymethyl)furan-2-carbohydrazide?
The canonical SMILES for N'-(2-fluorobenzoyl)-5-(phenoxymethyl)furan-2-carbohydrazide is O=C(NNC(=O)c1ccccc1F)c1ccc(COc2ccccc2)o1.
What is the InChIKey of N'-(2-fluorobenzoyl)-5-(phenoxymethyl)furan-2-carbohydrazide?
The InChIKey is JLDDNBFMANWJDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15FN2O4/c20-16-9-5-4-8-15(16)18(23)21-22-19(24)17-11-10-14(26-17)12-25-13-6-2-1-3-7-13/h1-11H,12H2,(H,21,23)(H,22,24).
What are the key properties of N'-(2-fluorobenzoyl)-5-(phenoxymethyl)furan-2-carbohydrazide?
N'-(2-fluorobenzoyl)-5-(phenoxymethyl)furan-2-carbohydrazide has a molecular weight of 354.34 g/mol, XLogP of 3.07, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2-fluorobenzoyl)-5-(phenoxymethyl)furan-2-carbohydrazide is sourced from PubChem (CID 4795196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).