N'-[2-(3-methylphenoxy)acetyl]furan-3-carbohydrazide

C14H14N2O4 — CID 51264727

IUPACN'-[2-(3-methylphenoxy)acetyl]furan-3-carbohydrazide
SMILESCc1cccc(OCC(=O)NNC(=O)c2ccoc2)c1
InChIInChI=1S/C14H14N2O4/c1-10-3-2-4-12(7-10)20-9-13(17)15-16-14(18)11-5-6-19-8-11/h2-8H,9H2,1H3,(H,15,17)(H,16,18)
InChIKeyFGRFGKQVKMKQOP-UHFFFAOYSA-N
MW274.28 g/mol
LogP1.43
Rot. Bonds4

About N'-[2-(3-methylphenoxy)acetyl]furan-3-carbohydrazide

N'-[2-(3-methylphenoxy)acetyl]furan-3-carbohydrazide (PubChem CID 51264727) has the molecular formula C14H14N2O4 and a molecular weight of 274.28 g/mol. Its IUPAC name is N'-[2-(3-methylphenoxy)acetyl]furan-3-carbohydrazide.

Molecular Properties

Compound NameN'-[2-(3-methylphenoxy)acetyl]furan-3-carbohydrazide
PubChem CID51264727
Molecular FormulaC14H14N2O4
Molecular Weight274.28 g/mol
Exact Mass274.10
IUPAC NameN'-[2-(3-methylphenoxy)acetyl]furan-3-carbohydrazide
SMILESCc1cccc(OCC(=O)NNC(=O)c2ccoc2)c1
InChIInChI=1S/C14H14N2O4/c1-10-3-2-4-12(7-10)20-9-13(17)15-16-14(18)11-5-6-19-8-11/h2-8H,9H2,1H3,(H,15,17)(H,16,18)
InChIKeyFGRFGKQVKMKQOP-UHFFFAOYSA-N
XLogP1.43
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 ≤ 51.43
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

3-methyl-N'-[2-(3-methylphenoxy)acetyl]benzohydrazide
CID 732321
4-benzoyl-N'-[2-(3-methylphenoxy)acetyl]benzohydrazide
CID 7601018
N'-[2-(3-methylphenoxy)acetyl]-3-(2-phenoxyethoxy)benzohydrazide
CID 4955104
1-[4-(furan-3-carbonyl)piperazin-1-yl]-2-(3-methylphenoxy)ethanone
CID 32531171
methyl 3-[2-[2-(3-methylphenoxy)acetyl]hydrazinyl]-3-oxopropanoate
CID 28638195
2-hydroxy-4-methyl-N'-[2-(3-methylphenoxy)acetyl]benzohydrazide
CID 51193302
2-ethoxy-N'-[2-(3-methylphenoxy)acetyl]acetohydrazide
CID 17140856
3-methyl-N'-[2-(3-methylphenoxy)acetyl]-4-nitrobenzohydrazide
CID 7943194
N-(furan-3-ylmethylideneamino)-2-(3-methylphenoxy)acetamide
CID 4923111
N-methyl-2-(3-methylphenoxy)acetamide
CID 15943355
3-bromo-4-tert-butyl-N'-[2-(3-methylphenoxy)acetyl]benzohydrazide
CID 3400798
3-hydroxy-N'-[2-(3-methylphenoxy)acetyl]naphthalene-2-carbohydrazide
CID 27567090

Frequently Asked Questions

What is the IUPAC name of N'-[2-(3-methylphenoxy)acetyl]furan-3-carbohydrazide?
The IUPAC name of N'-[2-(3-methylphenoxy)acetyl]furan-3-carbohydrazide (CID 51264727) is N'-[2-(3-methylphenoxy)acetyl]furan-3-carbohydrazide.
What is the SMILES notation for N'-[2-(3-methylphenoxy)acetyl]furan-3-carbohydrazide?
The canonical SMILES for N'-[2-(3-methylphenoxy)acetyl]furan-3-carbohydrazide is Cc1cccc(OCC(=O)NNC(=O)c2ccoc2)c1.
What is the InChIKey of N'-[2-(3-methylphenoxy)acetyl]furan-3-carbohydrazide?
The InChIKey is FGRFGKQVKMKQOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O4/c1-10-3-2-4-12(7-10)20-9-13(17)15-16-14(18)11-5-6-19-8-11/h2-8H,9H2,1H3,(H,15,17)(H,16,18).
What are the key properties of N'-[2-(3-methylphenoxy)acetyl]furan-3-carbohydrazide?
N'-[2-(3-methylphenoxy)acetyl]furan-3-carbohydrazide has a molecular weight of 274.28 g/mol, XLogP of 1.43, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[2-(3-methylphenoxy)acetyl]furan-3-carbohydrazide is sourced from PubChem (CID 51264727), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).