1-(2,4,5-trimethylfuran-3-yl)butylhydrazine

C11H20N2O — CID 105282209

IUPAC1-(2,4,5-trimethylfuran-3-yl)butylhydrazine
SMILESCCCC(NN)c1c(C)oc(C)c1C
InChIInChI=1S/C11H20N2O/c1-5-6-10(13-12)11-7(2)8(3)14-9(11)4/h10,13H,5-6,12H2,1-4H3
InChIKeyXGMNMUAPRIHJSY-UHFFFAOYSA-N
MW196.29 g/mol
LogP2.51
Rot. Bonds4

About 1-(2,4,5-trimethylfuran-3-yl)butylhydrazine

1-(2,4,5-trimethylfuran-3-yl)butylhydrazine (PubChem CID 105282209) has the molecular formula C11H20N2O and a molecular weight of 196.29 g/mol. Its IUPAC name is 1-(2,4,5-trimethylfuran-3-yl)butylhydrazine.

Molecular Properties

Compound Name1-(2,4,5-trimethylfuran-3-yl)butylhydrazine
PubChem CID105282209
Molecular FormulaC11H20N2O
Molecular Weight196.29 g/mol
Exact Mass196.16
IUPAC Name1-(2,4,5-trimethylfuran-3-yl)butylhydrazine
SMILESCCCC(NN)c1c(C)oc(C)c1C
InChIInChI=1S/C11H20N2O/c1-5-6-10(13-12)11-7(2)8(3)14-9(11)4/h10,13H,5-6,12H2,1-4H3
InChIKeyXGMNMUAPRIHJSY-UHFFFAOYSA-N
XLogP2.51
TPSA51.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.29
LogP ≤ 52.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 1-(2,4,5-trimethylfuran-3-yl)butylhydrazine 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

N-methyl-1-(2,4,5-trimethylfuran-3-yl)butan-1-amine
CID 114982292
1-(2,4,5-trimethylfuran-3-yl)pent-4-ynylhydrazine
CID 105307830
[2-(4,5-dimethyl-1,3-thiazol-2-yl)-1-(2,4,5-trimethylfuran-3-yl)ethyl]hydrazine
CID 105326755
[2-phenyl-1-(2,4,5-trimethylfuran-3-yl)ethyl]hydrazine
CID 105283083
1-(2,4,6-trimethylphenyl)butylhydrazine
CID 105282251
N-propyl-1-(2,4,5-trimethylfuran-3-yl)nonan-1-amine
CID 115835826
N,2-dimethyl-1-(2,4,5-trimethylfuran-3-yl)pentan-1-amine
CID 107894126
[2-(2,5-dimethylphenyl)-1-(2,4,5-trimethylfuran-3-yl)ethyl]hydrazine
CID 105287695
[2-(2-methyl-1,3-thiazol-4-yl)-1-(2,4,5-trimethylfuran-3-yl)ethyl]hydrazine
CID 105316117
4-ethylsulfonyl-N-propyl-1-(2,4,5-trimethylfuran-3-yl)butan-1-amine
CID 104986249
[2-(4-chloro-3-fluorophenyl)-1-(2,4,5-trimethylfuran-3-yl)ethyl]hydrazine
CID 107895489
[2-(2-chloro-3-fluorophenyl)-1-(2,4,5-trimethylfuran-3-yl)ethyl]hydrazine
CID 105332792

Frequently Asked Questions

What is the IUPAC name of 1-(2,4,5-trimethylfuran-3-yl)butylhydrazine?
The IUPAC name of 1-(2,4,5-trimethylfuran-3-yl)butylhydrazine (CID 105282209) is 1-(2,4,5-trimethylfuran-3-yl)butylhydrazine.
What is the SMILES notation for 1-(2,4,5-trimethylfuran-3-yl)butylhydrazine?
The canonical SMILES for 1-(2,4,5-trimethylfuran-3-yl)butylhydrazine is CCCC(NN)c1c(C)oc(C)c1C.
What is the InChIKey of 1-(2,4,5-trimethylfuran-3-yl)butylhydrazine?
The InChIKey is XGMNMUAPRIHJSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O/c1-5-6-10(13-12)11-7(2)8(3)14-9(11)4/h10,13H,5-6,12H2,1-4H3.
What are the key properties of 1-(2,4,5-trimethylfuran-3-yl)butylhydrazine?
1-(2,4,5-trimethylfuran-3-yl)butylhydrazine has a molecular weight of 196.29 g/mol, XLogP of 2.51, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,4,5-trimethylfuran-3-yl)butylhydrazine is sourced from PubChem (CID 105282209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).