[2-(3,4-dimethylphenyl)-1-(furan-2-yl)ethyl]hydrazine

C14H18N2O — CID 105213578

IUPAC[2-(3,4-dimethylphenyl)-1-(furan-2-yl)ethyl]hydrazine
SMILESCc1ccc(CC(NN)c2ccco2)cc1C
InChIInChI=1S/C14H18N2O/c1-10-5-6-12(8-11(10)2)9-13(16-15)14-4-3-7-17-14/h3-8,13,16H,9,15H2,1-2H3
InChIKeyOOBFXLGHUVUPAO-UHFFFAOYSA-N
MW230.31 g/mol
LogP2.64
Rot. Bonds4

About [2-(3,4-dimethylphenyl)-1-(furan-2-yl)ethyl]hydrazine

[2-(3,4-dimethylphenyl)-1-(furan-2-yl)ethyl]hydrazine (PubChem CID 105213578) has the molecular formula C14H18N2O and a molecular weight of 230.31 g/mol. Its IUPAC name is [2-(3,4-dimethylphenyl)-1-(furan-2-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(3,4-dimethylphenyl)-1-(furan-2-yl)ethyl]hydrazine
PubChem CID105213578
Molecular FormulaC14H18N2O
Molecular Weight230.31 g/mol
Exact Mass230.14
IUPAC Name[2-(3,4-dimethylphenyl)-1-(furan-2-yl)ethyl]hydrazine
SMILESCc1ccc(CC(NN)c2ccco2)cc1C
InChIInChI=1S/C14H18N2O/c1-10-5-6-12(8-11(10)2)9-13(16-15)14-4-3-7-17-14/h3-8,13,16H,9,15H2,1-2H3
InChIKeyOOBFXLGHUVUPAO-UHFFFAOYSA-N
XLogP2.64
TPSA51.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.31
LogP ≤ 52.64
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'}

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Frequently Asked Questions

What is the IUPAC name of [2-(3,4-dimethylphenyl)-1-(furan-2-yl)ethyl]hydrazine?
The IUPAC name of [2-(3,4-dimethylphenyl)-1-(furan-2-yl)ethyl]hydrazine (CID 105213578) is [2-(3,4-dimethylphenyl)-1-(furan-2-yl)ethyl]hydrazine.
What is the SMILES notation for [2-(3,4-dimethylphenyl)-1-(furan-2-yl)ethyl]hydrazine?
The canonical SMILES for [2-(3,4-dimethylphenyl)-1-(furan-2-yl)ethyl]hydrazine is Cc1ccc(CC(NN)c2ccco2)cc1C.
What is the InChIKey of [2-(3,4-dimethylphenyl)-1-(furan-2-yl)ethyl]hydrazine?
The InChIKey is OOBFXLGHUVUPAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O/c1-10-5-6-12(8-11(10)2)9-13(16-15)14-4-3-7-17-14/h3-8,13,16H,9,15H2,1-2H3.
What are the key properties of [2-(3,4-dimethylphenyl)-1-(furan-2-yl)ethyl]hydrazine?
[2-(3,4-dimethylphenyl)-1-(furan-2-yl)ethyl]hydrazine has a molecular weight of 230.31 g/mol, XLogP of 2.64, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(3,4-dimethylphenyl)-1-(furan-2-yl)ethyl]hydrazine is sourced from PubChem (CID 105213578), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).