5-[[ethyl(furan-2-ylmethyl)amino]methyl]-2-methylfuran-3-carbohydrazide

C14H19N3O3 — CID 63579462

IUPAC5-[[ethyl(furan-2-ylmethyl)amino]methyl]-2-methylfuran-3-carbohydrazide
SMILESCCN(Cc1ccco1)Cc1cc(C(=O)NN)c(C)o1
InChIInChI=1S/C14H19N3O3/c1-3-17(8-11-5-4-6-19-11)9-12-7-13(10(2)20-12)14(18)16-15/h4-7H,3,8-9,15H2,1-2H3,(H,16,18)
InChIKeyPXZNKZPLGIISOW-UHFFFAOYSA-N
MW277.32 g/mol
LogP1.81
Rot. Bonds6

About 5-[[ethyl(furan-2-ylmethyl)amino]methyl]-2-methylfuran-3-carbohydrazide

5-[[ethyl(furan-2-ylmethyl)amino]methyl]-2-methylfuran-3-carbohydrazide (PubChem CID 63579462) has the molecular formula C14H19N3O3 and a molecular weight of 277.32 g/mol. Its IUPAC name is 5-[[ethyl(furan-2-ylmethyl)amino]methyl]-2-methylfuran-3-carbohydrazide.

Molecular Properties

Compound Name5-[[ethyl(furan-2-ylmethyl)amino]methyl]-2-methylfuran-3-carbohydrazide
PubChem CID63579462
Molecular FormulaC14H19N3O3
Molecular Weight277.32 g/mol
Exact Mass277.14
IUPAC Name5-[[ethyl(furan-2-ylmethyl)amino]methyl]-2-methylfuran-3-carbohydrazide
SMILESCCN(Cc1ccco1)Cc1cc(C(=O)NN)c(C)o1
InChIInChI=1S/C14H19N3O3/c1-3-17(8-11-5-4-6-19-11)9-12-7-13(10(2)20-12)14(18)16-15/h4-7H,3,8-9,15H2,1-2H3,(H,16,18)
InChIKeyPXZNKZPLGIISOW-UHFFFAOYSA-N
XLogP1.81
TPSA84.64 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.32
LogP ≤ 51.81
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'}

Analyze 5-[[ethyl(furan-2-ylmethyl)amino]methyl]-2-methylfuran-3-carbohydrazide with MolForge

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Related Compounds

4-[[ethyl(furan-2-ylmethyl)amino]methyl]-5-methylthiophene-2-carbohydrazide
CID 80733881
5-[[cyclobutylmethyl(ethyl)amino]methyl]-2-methylfuran-3-carbohydrazide
CID 107402375
2-methyl-5-[[methyl(propyl)amino]methyl]furan-3-carbohydrazide
CID 63572711
methyl 5-[[furan-2-ylmethyl(thiophen-2-ylmethyl)amino]methyl]-2-methylfuran-3-carboxylate
CID 78807455
methyl 5-[[furan-2-ylmethyl-[(5-methylthiophen-2-yl)methyl]amino]methyl]-2-methylfuran-3-carboxylate
CID 78899836
5-[[ethyl(furan-2-ylmethyl)amino]methyl]-1,2-oxazole-3-carboxylic acid
CID 61423513
methyl 5-[[ethyl(thiophen-2-ylmethyl)amino]methyl]-2-methylfuran-3-carboxylate
CID 78807159
methyl 4-[[ethyl(furan-2-ylmethyl)amino]methyl]-2-fluorobenzoate
CID 103749274
1-[ethyl(furan-2-ylmethyl)amino]-3-methylbutan-2-one
CID 79395471
2-(diethylaminomethyl)furan-3-carbohydrazide
CID 63570482
2-[ethyl(furan-2-ylmethyl)amino]-1-phenylethanone
CID 62037006
N-[[4-[[ethyl(furan-2-ylmethyl)amino]methyl]phenyl]methyl]ethanamine
CID 62461578

Frequently Asked Questions

What is the IUPAC name of 5-[[ethyl(furan-2-ylmethyl)amino]methyl]-2-methylfuran-3-carbohydrazide?
The IUPAC name of 5-[[ethyl(furan-2-ylmethyl)amino]methyl]-2-methylfuran-3-carbohydrazide (CID 63579462) is 5-[[ethyl(furan-2-ylmethyl)amino]methyl]-2-methylfuran-3-carbohydrazide.
What is the SMILES notation for 5-[[ethyl(furan-2-ylmethyl)amino]methyl]-2-methylfuran-3-carbohydrazide?
The canonical SMILES for 5-[[ethyl(furan-2-ylmethyl)amino]methyl]-2-methylfuran-3-carbohydrazide is CCN(Cc1ccco1)Cc1cc(C(=O)NN)c(C)o1.
What is the InChIKey of 5-[[ethyl(furan-2-ylmethyl)amino]methyl]-2-methylfuran-3-carbohydrazide?
The InChIKey is PXZNKZPLGIISOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O3/c1-3-17(8-11-5-4-6-19-11)9-12-7-13(10(2)20-12)14(18)16-15/h4-7H,3,8-9,15H2,1-2H3,(H,16,18).
What are the key properties of 5-[[ethyl(furan-2-ylmethyl)amino]methyl]-2-methylfuran-3-carbohydrazide?
5-[[ethyl(furan-2-ylmethyl)amino]methyl]-2-methylfuran-3-carbohydrazide has a molecular weight of 277.32 g/mol, XLogP of 1.81, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[[ethyl(furan-2-ylmethyl)amino]methyl]-2-methylfuran-3-carbohydrazide is sourced from PubChem (CID 63579462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).