[1-(2,3-dihydro-1-benzofuran-7-yl)-2,2-dimethylbutyl]hydrazine

C14H22N2O — CID 105341923

IUPAC[1-(2,3-dihydro-1-benzofuran-7-yl)-2,2-dimethylbutyl]hydrazine
SMILESCCC(C)(C)C(NN)c1cccc2c1OCC2
InChIInChI=1S/C14H22N2O/c1-4-14(2,3)13(16-15)11-7-5-6-10-8-9-17-12(10)11/h5-7,13,16H,4,8-9,15H2,1-3H3
InChIKeyUYLZRBGDSRZXNR-UHFFFAOYSA-N
MW234.34 g/mol
LogP2.56
Rot. Bonds4

About [1-(2,3-dihydro-1-benzofuran-7-yl)-2,2-dimethylbutyl]hydrazine

[1-(2,3-dihydro-1-benzofuran-7-yl)-2,2-dimethylbutyl]hydrazine (PubChem CID 105341923) has the molecular formula C14H22N2O and a molecular weight of 234.34 g/mol. Its IUPAC name is [1-(2,3-dihydro-1-benzofuran-7-yl)-2,2-dimethylbutyl]hydrazine.

Molecular Properties

Compound Name[1-(2,3-dihydro-1-benzofuran-7-yl)-2,2-dimethylbutyl]hydrazine
PubChem CID105341923
Molecular FormulaC14H22N2O
Molecular Weight234.34 g/mol
Exact Mass234.17
IUPAC Name[1-(2,3-dihydro-1-benzofuran-7-yl)-2,2-dimethylbutyl]hydrazine
SMILESCCC(C)(C)C(NN)c1cccc2c1OCC2
InChIInChI=1S/C14H22N2O/c1-4-14(2,3)13(16-15)11-7-5-6-10-8-9-17-12(10)11/h5-7,13,16H,4,8-9,15H2,1-3H3
InChIKeyUYLZRBGDSRZXNR-UHFFFAOYSA-N
XLogP2.56
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 52.56
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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Related Compounds

1-(2,3-dihydro-1-benzofuran-7-yl)-N-ethyl-2,2-dimethylbutan-1-amine
CID 105053334
1-(2,3-dihydro-1-benzofuran-7-yl)-3,3-dimethylbutan-1-amine
CID 114745358
1-(2,3-dihydro-1-benzofuran-7-yl)-2-methylbutane-1,2-diol
CID 103448783
[1-(2,3-dihydro-1-benzofuran-7-yl)-2-ethoxypropyl]hydrazine
CID 105223043
7-butan-2-yl-2,3-dihydro-1-benzofuran
CID 89030364
[1-(2,3-dihydro-1-benzofuran-7-yl)-2-propan-2-ylsulfanylethyl]hydrazine
CID 105226295
[1-(2,3-dihydro-1-benzofuran-7-yl)-4-methoxypentyl]hydrazine
CID 105341860
1-(2,3-dihydro-1-benzofuran-7-yl)-2-methyl-2-pyrrolidin-1-ylbutan-1-amine
CID 114745701
1-(3,4-dihydro-2H-chromen-8-yl)-2-methoxy-2-methyl-N-propylbutan-1-amine
CID 114746254
1-(2,3-dihydro-1-benzofuran-7-yl)-N-methylpentan-1-amine
CID 114745766
[2,2-dimethyl-1-(2-methylphenyl)butyl]hydrazine
CID 105286147
[1-(2,3-dihydro-1-benzofuran-7-yl)-2-(4-fluorophenyl)ethyl]hydrazine
CID 105198455

Frequently Asked Questions

What is the IUPAC name of [1-(2,3-dihydro-1-benzofuran-7-yl)-2,2-dimethylbutyl]hydrazine?
The IUPAC name of [1-(2,3-dihydro-1-benzofuran-7-yl)-2,2-dimethylbutyl]hydrazine (CID 105341923) is [1-(2,3-dihydro-1-benzofuran-7-yl)-2,2-dimethylbutyl]hydrazine.
What is the SMILES notation for [1-(2,3-dihydro-1-benzofuran-7-yl)-2,2-dimethylbutyl]hydrazine?
The canonical SMILES for [1-(2,3-dihydro-1-benzofuran-7-yl)-2,2-dimethylbutyl]hydrazine is CCC(C)(C)C(NN)c1cccc2c1OCC2.
What is the InChIKey of [1-(2,3-dihydro-1-benzofuran-7-yl)-2,2-dimethylbutyl]hydrazine?
The InChIKey is UYLZRBGDSRZXNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O/c1-4-14(2,3)13(16-15)11-7-5-6-10-8-9-17-12(10)11/h5-7,13,16H,4,8-9,15H2,1-3H3.
What are the key properties of [1-(2,3-dihydro-1-benzofuran-7-yl)-2,2-dimethylbutyl]hydrazine?
[1-(2,3-dihydro-1-benzofuran-7-yl)-2,2-dimethylbutyl]hydrazine has a molecular weight of 234.34 g/mol, XLogP of 2.56, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2,3-dihydro-1-benzofuran-7-yl)-2,2-dimethylbutyl]hydrazine is sourced from PubChem (CID 105341923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).