3-[(4-ethyl-2-methoxyphenoxy)methyl]furan-2-carbohydrazide

C15H18N2O4 — CID 107668802

IUPAC3-[(4-ethyl-2-methoxyphenoxy)methyl]furan-2-carbohydrazide
SMILESCCc1ccc(OCc2ccoc2C(=O)NN)c(OC)c1
InChIInChI=1S/C15H18N2O4/c1-3-10-4-5-12(13(8-10)19-2)21-9-11-6-7-20-14(11)15(18)17-16/h4-8H,3,9,16H2,1-2H3,(H,17,18)
InChIKeyFXYUMGQFLJEZNC-UHFFFAOYSA-N
MW290.32 g/mol
LogP2.03
Rot. Bonds6

About 3-[(4-ethyl-2-methoxyphenoxy)methyl]furan-2-carbohydrazide

3-[(4-ethyl-2-methoxyphenoxy)methyl]furan-2-carbohydrazide (PubChem CID 107668802) has the molecular formula C15H18N2O4 and a molecular weight of 290.32 g/mol. Its IUPAC name is 3-[(4-ethyl-2-methoxyphenoxy)methyl]furan-2-carbohydrazide.

Molecular Properties

Compound Name3-[(4-ethyl-2-methoxyphenoxy)methyl]furan-2-carbohydrazide
PubChem CID107668802
Molecular FormulaC15H18N2O4
Molecular Weight290.32 g/mol
Exact Mass290.13
IUPAC Name3-[(4-ethyl-2-methoxyphenoxy)methyl]furan-2-carbohydrazide
SMILESCCc1ccc(OCc2ccoc2C(=O)NN)c(OC)c1
InChIInChI=1S/C15H18N2O4/c1-3-10-4-5-12(13(8-10)19-2)21-9-11-6-7-20-14(11)15(18)17-16/h4-8H,3,9,16H2,1-2H3,(H,17,18)
InChIKeyFXYUMGQFLJEZNC-UHFFFAOYSA-N
XLogP2.03
TPSA86.72 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.32
LogP ≤ 52.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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'}

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Related Compounds

3-[(2-ethoxyphenoxy)methyl]furan-2-carbohydrazide
CID 63575637
3-[(2,5-dimethylphenoxy)methyl]furan-2-carbohydrazide
CID 63576692
[2-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxoethyl] 3-(phenoxymethyl)furan-2-carboxylate
CID 42450370
4-[(4-ethyl-2-methoxyphenoxy)methyl]benzoic acid
CID 104637822
3-[(4-cyano-2,6-dimethylphenoxy)methyl]furan-2-carbohydrazide
CID 65472904
N,N-diethyl-2-(4-ethyl-2-methoxyphenoxy)acetamide
CID 154118386
[5-[(4-ethyl-2-methoxyphenoxy)methyl]-1,3-thiazol-2-yl]hydrazine
CID 107668167
3-(quinolin-5-yloxymethyl)furan-2-carbohydrazide
CID 103045950
N'-[2-(6-ethyl-1-benzofuran-3-yl)acetyl]-3,4-dimethoxybenzohydrazide
CID 18164667
3-(1-ethoxypropan-2-yloxymethyl)furan-2-carbohydrazide
CID 103490879
2-(4-ethyl-2-methoxyphenoxy)ethanol
CID 67567470
N-[[5-[(4-ethyl-2-methoxyphenoxy)methyl]-1,2-oxazol-3-yl]methyl]ethanamine
CID 107668507

Frequently Asked Questions

What is the IUPAC name of 3-[(4-ethyl-2-methoxyphenoxy)methyl]furan-2-carbohydrazide?
The IUPAC name of 3-[(4-ethyl-2-methoxyphenoxy)methyl]furan-2-carbohydrazide (CID 107668802) is 3-[(4-ethyl-2-methoxyphenoxy)methyl]furan-2-carbohydrazide.
What is the SMILES notation for 3-[(4-ethyl-2-methoxyphenoxy)methyl]furan-2-carbohydrazide?
The canonical SMILES for 3-[(4-ethyl-2-methoxyphenoxy)methyl]furan-2-carbohydrazide is CCc1ccc(OCc2ccoc2C(=O)NN)c(OC)c1.
What is the InChIKey of 3-[(4-ethyl-2-methoxyphenoxy)methyl]furan-2-carbohydrazide?
The InChIKey is FXYUMGQFLJEZNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O4/c1-3-10-4-5-12(13(8-10)19-2)21-9-11-6-7-20-14(11)15(18)17-16/h4-8H,3,9,16H2,1-2H3,(H,17,18).
What are the key properties of 3-[(4-ethyl-2-methoxyphenoxy)methyl]furan-2-carbohydrazide?
3-[(4-ethyl-2-methoxyphenoxy)methyl]furan-2-carbohydrazide has a molecular weight of 290.32 g/mol, XLogP of 2.03, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(4-ethyl-2-methoxyphenoxy)methyl]furan-2-carbohydrazide is sourced from PubChem (CID 107668802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).