5-(phenylmethoxymethyl)furan-3-carbohydrazide

C13H14N2O3 — CID 55213199

IUPAC5-(phenylmethoxymethyl)furan-3-carbohydrazide
SMILESNNC(=O)c1coc(COCc2ccccc2)c1
InChIInChI=1S/C13H14N2O3/c14-15-13(16)11-6-12(18-8-11)9-17-7-10-4-2-1-3-5-10/h1-6,8H,7,9,14H2,(H,15,16)
InChIKeyAHJNMRVUTCUCLX-UHFFFAOYSA-N
MW246.27 g/mol
LogP1.60
Rot. Bonds5

About 5-(phenylmethoxymethyl)furan-3-carbohydrazide

5-(phenylmethoxymethyl)furan-3-carbohydrazide (PubChem CID 55213199) has the molecular formula C13H14N2O3 and a molecular weight of 246.27 g/mol. Its IUPAC name is 5-(phenylmethoxymethyl)furan-3-carbohydrazide.

Molecular Properties

Compound Name5-(phenylmethoxymethyl)furan-3-carbohydrazide
PubChem CID55213199
Molecular FormulaC13H14N2O3
Molecular Weight246.27 g/mol
Exact Mass246.10
IUPAC Name5-(phenylmethoxymethyl)furan-3-carbohydrazide
SMILESNNC(=O)c1coc(COCc2ccccc2)c1
InChIInChI=1S/C13H14N2O3/c14-15-13(16)11-6-12(18-8-11)9-17-7-10-4-2-1-3-5-10/h1-6,8H,7,9,14H2,(H,15,16)
InChIKeyAHJNMRVUTCUCLX-UHFFFAOYSA-N
XLogP1.60
TPSA77.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.27
LogP ≤ 51.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 5-(phenylmethoxymethyl)furan-3-carbohydrazide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-(2-ethoxyethoxymethyl)furan-3-carbohydrazide
CID 63588537
5-(3-pyridin-4-ylpropoxymethyl)furan-3-carbohydrazide
CID 63575748
5-(propan-2-yloxymethyl)furan-3-carbohydrazide
CID 63574391
5-[(3-methylphenoxy)methyl]furan-3-carbohydrazide
CID 63576172
5-[(2,3-dichlorophenoxy)methyl]furan-3-carbohydrazide
CID 63575027
5-[(2,3,5,6-tetrafluorophenoxy)methyl]furan-3-carbohydrazide
CID 103290412
2,5-bis(phenylmethoxy)benzene-1,4-dicarbohydrazide
CID 155221310
5-[(3-fluoro-4-methylphenoxy)methyl]furan-3-carbohydrazide
CID 107171042
5-(naphthalen-2-ylsulfanylmethyl)furan-3-carbohydrazide
CID 63581398
5-[(2-nitro-3-pyridinyl)oxymethyl]furan-3-carbohydrazide
CID 63575736
3-(3-phenylpropoxymethyl)benzohydrazide
CID 63569149
5-[(2-chloro-6-nitrophenoxy)methyl]furan-3-carbohydrazide
CID 107719018

Frequently Asked Questions

What is the IUPAC name of 5-(phenylmethoxymethyl)furan-3-carbohydrazide?
The IUPAC name of 5-(phenylmethoxymethyl)furan-3-carbohydrazide (CID 55213199) is 5-(phenylmethoxymethyl)furan-3-carbohydrazide.
What is the SMILES notation for 5-(phenylmethoxymethyl)furan-3-carbohydrazide?
The canonical SMILES for 5-(phenylmethoxymethyl)furan-3-carbohydrazide is NNC(=O)c1coc(COCc2ccccc2)c1.
What is the InChIKey of 5-(phenylmethoxymethyl)furan-3-carbohydrazide?
The InChIKey is AHJNMRVUTCUCLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O3/c14-15-13(16)11-6-12(18-8-11)9-17-7-10-4-2-1-3-5-10/h1-6,8H,7,9,14H2,(H,15,16).
What are the key properties of 5-(phenylmethoxymethyl)furan-3-carbohydrazide?
5-(phenylmethoxymethyl)furan-3-carbohydrazide has a molecular weight of 246.27 g/mol, XLogP of 1.60, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(phenylmethoxymethyl)furan-3-carbohydrazide is sourced from PubChem (CID 55213199), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).