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

C15H16N2O5 — CID 31466053

IUPACN'-(2-methoxyacetyl)-5-(phenoxymethyl)furan-2-carbohydrazide
SMILESCOCC(=O)NNC(=O)c1ccc(COc2ccccc2)o1
InChIInChI=1S/C15H16N2O5/c1-20-10-14(18)16-17-15(19)13-8-7-12(22-13)9-21-11-5-3-2-4-6-11/h2-8H,9-10H2,1H3,(H,16,18)(H,17,19)
InChIKeyKCQXTYCFRYZZLC-UHFFFAOYSA-N
MW304.30 g/mol
LogP1.27
Rot. Bonds6

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

N'-(2-methoxyacetyl)-5-(phenoxymethyl)furan-2-carbohydrazide (PubChem CID 31466053) has the molecular formula C15H16N2O5 and a molecular weight of 304.30 g/mol. Its IUPAC name is N'-(2-methoxyacetyl)-5-(phenoxymethyl)furan-2-carbohydrazide.

Molecular Properties

Compound NameN'-(2-methoxyacetyl)-5-(phenoxymethyl)furan-2-carbohydrazide
PubChem CID31466053
Molecular FormulaC15H16N2O5
Molecular Weight304.30 g/mol
Exact Mass304.11
IUPAC NameN'-(2-methoxyacetyl)-5-(phenoxymethyl)furan-2-carbohydrazide
SMILESCOCC(=O)NNC(=O)c1ccc(COc2ccccc2)o1
InChIInChI=1S/C15H16N2O5/c1-20-10-14(18)16-17-15(19)13-8-7-12(22-13)9-21-11-5-3-2-4-6-11/h2-8H,9-10H2,1H3,(H,16,18)(H,17,19)
InChIKeyKCQXTYCFRYZZLC-UHFFFAOYSA-N
XLogP1.27
TPSA89.80 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.30
LogP ≤ 51.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

N'-[2-(4-ethylphenoxy)acetyl]-5-(phenoxymethyl)furan-2-carbohydrazide
CID 26717724
N'-[2-(4-ethoxyphenoxy)acetyl]-5-(phenoxymethyl)furan-2-carbohydrazide
CID 9219862
N'-[2-(4-hydroxyphenyl)acetyl]-5-(phenoxymethyl)furan-2-carbohydrazide
CID 78822023
N'-(4-phenoxybutanoyl)-5-(phenoxymethyl)furan-2-carbohydrazide
CID 31837131
N'-[2-(2-methylphenyl)acetyl]-5-(phenoxymethyl)furan-2-carbohydrazide
CID 18204877
N'-[2-(3,4-dimethoxyphenyl)acetyl]-5-(phenoxymethyl)furan-2-carbohydrazide
CID 9219844
N'-[2-(4-chlorophenyl)acetyl]-5-(phenoxymethyl)furan-2-carbohydrazide
CID 9219836
N-methyl-5-(phenoxymethyl)furan-2-carboxamide
CID 7678218
N'-(4-methylbenzoyl)-5-(phenoxymethyl)furan-2-carbohydrazide
CID 7979169
[2-(2-benzoylhydrazinyl)-2-oxoethyl] 5-(phenoxymethyl)furan-2-carboxylate
CID 7468711
[2-(2-methoxyethylamino)-2-oxoethyl] 5-(phenoxymethyl)furan-2-carboxylate
CID 7892996
N'-(2-fluorobenzoyl)-5-(phenoxymethyl)furan-2-carbohydrazide
CID 4795196

Frequently Asked Questions

What is the IUPAC name of N'-(2-methoxyacetyl)-5-(phenoxymethyl)furan-2-carbohydrazide?
The IUPAC name of N'-(2-methoxyacetyl)-5-(phenoxymethyl)furan-2-carbohydrazide (CID 31466053) is N'-(2-methoxyacetyl)-5-(phenoxymethyl)furan-2-carbohydrazide.
What is the SMILES notation for N'-(2-methoxyacetyl)-5-(phenoxymethyl)furan-2-carbohydrazide?
The canonical SMILES for N'-(2-methoxyacetyl)-5-(phenoxymethyl)furan-2-carbohydrazide is COCC(=O)NNC(=O)c1ccc(COc2ccccc2)o1.
What is the InChIKey of N'-(2-methoxyacetyl)-5-(phenoxymethyl)furan-2-carbohydrazide?
The InChIKey is KCQXTYCFRYZZLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O5/c1-20-10-14(18)16-17-15(19)13-8-7-12(22-13)9-21-11-5-3-2-4-6-11/h2-8H,9-10H2,1H3,(H,16,18)(H,17,19).
What are the key properties of N'-(2-methoxyacetyl)-5-(phenoxymethyl)furan-2-carbohydrazide?
N'-(2-methoxyacetyl)-5-(phenoxymethyl)furan-2-carbohydrazide has a molecular weight of 304.30 g/mol, XLogP of 1.27, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2-methoxyacetyl)-5-(phenoxymethyl)furan-2-carbohydrazide is sourced from PubChem (CID 31466053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).