5-[(3-methoxyphenyl)methoxymethyl]-3-methylfuran-2-carbohydrazide

C15H18N2O4 — CID 63588133

IUPAC5-[(3-methoxyphenyl)methoxymethyl]-3-methylfuran-2-carbohydrazide
SMILESCOc1cccc(COCc2cc(C)c(C(=O)NN)o2)c1
InChIInChI=1S/C15H18N2O4/c1-10-6-13(21-14(10)15(18)17-16)9-20-8-11-4-3-5-12(7-11)19-2/h3-7H,8-9,16H2,1-2H3,(H,17,18)
InChIKeyJXNDMKYOGKUVDM-UHFFFAOYSA-N
MW290.32 g/mol
LogP1.92
Rot. Bonds6

About 5-[(3-methoxyphenyl)methoxymethyl]-3-methylfuran-2-carbohydrazide

5-[(3-methoxyphenyl)methoxymethyl]-3-methylfuran-2-carbohydrazide (PubChem CID 63588133) has the molecular formula C15H18N2O4 and a molecular weight of 290.32 g/mol. Its IUPAC name is 5-[(3-methoxyphenyl)methoxymethyl]-3-methylfuran-2-carbohydrazide.

Molecular Properties

Compound Name5-[(3-methoxyphenyl)methoxymethyl]-3-methylfuran-2-carbohydrazide
PubChem CID63588133
Molecular FormulaC15H18N2O4
Molecular Weight290.32 g/mol
Exact Mass290.13
IUPAC Name5-[(3-methoxyphenyl)methoxymethyl]-3-methylfuran-2-carbohydrazide
SMILESCOc1cccc(COCc2cc(C)c(C(=O)NN)o2)c1
InChIInChI=1S/C15H18N2O4/c1-10-6-13(21-14(10)15(18)17-16)9-20-8-11-4-3-5-12(7-11)19-2/h3-7H,8-9,16H2,1-2H3,(H,17,18)
InChIKeyJXNDMKYOGKUVDM-UHFFFAOYSA-N
XLogP1.92
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 ≤ 51.92
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

5-[[3-(methoxymethyl)phenoxy]methyl]-3-methylfuran-2-carbohydrazide
CID 63985457
4-[(3-methoxyphenyl)methoxymethyl]-5-methylfuran-2-carbohydrazide
CID 63587965
5-[[(3-methoxyphenyl)methylamino]methyl]-3-methylfuran-2-carboxylic acid
CID 103239896
5-(2-ethoxyethoxymethyl)-3-methylfuran-2-carbohydrazide
CID 63588542
5-[(3-bromo-4-fluorophenoxy)methyl]-3-methylfuran-2-carbohydrazide
CID 83234267
methyl 3-[(3-methoxyphenyl)methoxy]-2-methylpropanoate
CID 43537941
ethyl 4-[(3-methoxyphenyl)methoxy]-3-oxobutanoate
CID 63892220
5-[[(3-methoxyphenyl)methyl-methylamino]methyl]furan-2-carbohydrazide
CID 63578444
4-[(3-methoxyphenyl)methoxymethyl]benzoic acid
CID 24689583
[4-[(3-methoxyphenyl)methoxymethyl]-2-pyridinyl]hydrazine
CID 62464124
5-[(2-methoxyphenyl)sulfanylmethyl]-3-methylfuran-2-carbohydrazide
CID 63581648
5-(2,3-dihydro-1H-inden-5-yloxymethyl)-3-methylfuran-2-carbohydrazide
CID 63574877

Frequently Asked Questions

What is the IUPAC name of 5-[(3-methoxyphenyl)methoxymethyl]-3-methylfuran-2-carbohydrazide?
The IUPAC name of 5-[(3-methoxyphenyl)methoxymethyl]-3-methylfuran-2-carbohydrazide (CID 63588133) is 5-[(3-methoxyphenyl)methoxymethyl]-3-methylfuran-2-carbohydrazide.
What is the SMILES notation for 5-[(3-methoxyphenyl)methoxymethyl]-3-methylfuran-2-carbohydrazide?
The canonical SMILES for 5-[(3-methoxyphenyl)methoxymethyl]-3-methylfuran-2-carbohydrazide is COc1cccc(COCc2cc(C)c(C(=O)NN)o2)c1.
What is the InChIKey of 5-[(3-methoxyphenyl)methoxymethyl]-3-methylfuran-2-carbohydrazide?
The InChIKey is JXNDMKYOGKUVDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O4/c1-10-6-13(21-14(10)15(18)17-16)9-20-8-11-4-3-5-12(7-11)19-2/h3-7H,8-9,16H2,1-2H3,(H,17,18).
What are the key properties of 5-[(3-methoxyphenyl)methoxymethyl]-3-methylfuran-2-carbohydrazide?
5-[(3-methoxyphenyl)methoxymethyl]-3-methylfuran-2-carbohydrazide has a molecular weight of 290.32 g/mol, XLogP of 1.92, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(3-methoxyphenyl)methoxymethyl]-3-methylfuran-2-carbohydrazide is sourced from PubChem (CID 63588133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).