N'-(2-phenoxypropanoyl)furan-2-carbohydrazide

C14H14N2O4 — CID 3693666

IUPACN'-(2-phenoxypropanoyl)furan-2-carbohydrazide
SMILESCC(Oc1ccccc1)C(=O)NNC(=O)c1ccco1
InChIInChI=1S/C14H14N2O4/c1-10(20-11-6-3-2-4-7-11)13(17)15-16-14(18)12-8-5-9-19-12/h2-10H,1H3,(H,15,17)(H,16,18)
InChIKeyVTKSXIGPMRNKGR-UHFFFAOYSA-N
MW274.28 g/mol
LogP1.51
Rot. Bonds4

About N'-(2-phenoxypropanoyl)furan-2-carbohydrazide

N'-(2-phenoxypropanoyl)furan-2-carbohydrazide (PubChem CID 3693666) has the molecular formula C14H14N2O4 and a molecular weight of 274.28 g/mol. Its IUPAC name is N'-(2-phenoxypropanoyl)furan-2-carbohydrazide.

Molecular Properties

Compound NameN'-(2-phenoxypropanoyl)furan-2-carbohydrazide
PubChem CID3693666
Molecular FormulaC14H14N2O4
Molecular Weight274.28 g/mol
Exact Mass274.10
IUPAC NameN'-(2-phenoxypropanoyl)furan-2-carbohydrazide
SMILESCC(Oc1ccccc1)C(=O)NNC(=O)c1ccco1
InChIInChI=1S/C14H14N2O4/c1-10(20-11-6-3-2-4-7-11)13(17)15-16-14(18)12-8-5-9-19-12/h2-10H,1H3,(H,15,17)(H,16,18)
InChIKeyVTKSXIGPMRNKGR-UHFFFAOYSA-N
XLogP1.51
TPSA80.57 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.28
LogP ≤ 51.51
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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Frequently Asked Questions

What is the IUPAC name of N'-(2-phenoxypropanoyl)furan-2-carbohydrazide?
The IUPAC name of N'-(2-phenoxypropanoyl)furan-2-carbohydrazide (CID 3693666) is N'-(2-phenoxypropanoyl)furan-2-carbohydrazide.
What is the SMILES notation for N'-(2-phenoxypropanoyl)furan-2-carbohydrazide?
The canonical SMILES for N'-(2-phenoxypropanoyl)furan-2-carbohydrazide is CC(Oc1ccccc1)C(=O)NNC(=O)c1ccco1.
What is the InChIKey of N'-(2-phenoxypropanoyl)furan-2-carbohydrazide?
The InChIKey is VTKSXIGPMRNKGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O4/c1-10(20-11-6-3-2-4-7-11)13(17)15-16-14(18)12-8-5-9-19-12/h2-10H,1H3,(H,15,17)(H,16,18).
What are the key properties of N'-(2-phenoxypropanoyl)furan-2-carbohydrazide?
N'-(2-phenoxypropanoyl)furan-2-carbohydrazide has a molecular weight of 274.28 g/mol, XLogP of 1.51, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2-phenoxypropanoyl)furan-2-carbohydrazide is sourced from PubChem (CID 3693666), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).