[1-(2,3-dihydro-1-benzofuran-2-yl)-2-(3-ethyl-1-methylpyrazol-5-yl)ethyl]hydrazine

C16H22N4O — CID 105263051

IUPAC[1-(2,3-dihydro-1-benzofuran-2-yl)-2-(3-ethyl-1-methylpyrazol-5-yl)ethyl]hydrazine
SMILESCCc1cc(CC(NN)C2Cc3ccccc3O2)n(C)n1
InChIInChI=1S/C16H22N4O/c1-3-12-9-13(20(2)19-12)10-14(18-17)16-8-11-6-4-5-7-15(11)21-16/h4-7,9,14,16,18H,3,8,10,17H2,1-2H3
InChIKeyDJKLEVLKGHVQKE-UHFFFAOYSA-N
MW286.38 g/mol
LogP1.36
Rot. Bonds5

About [1-(2,3-dihydro-1-benzofuran-2-yl)-2-(3-ethyl-1-methylpyrazol-5-yl)ethyl]hydrazine

[1-(2,3-dihydro-1-benzofuran-2-yl)-2-(3-ethyl-1-methylpyrazol-5-yl)ethyl]hydrazine (PubChem CID 105263051) has the molecular formula C16H22N4O and a molecular weight of 286.38 g/mol. Its IUPAC name is [1-(2,3-dihydro-1-benzofuran-2-yl)-2-(3-ethyl-1-methylpyrazol-5-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[1-(2,3-dihydro-1-benzofuran-2-yl)-2-(3-ethyl-1-methylpyrazol-5-yl)ethyl]hydrazine
PubChem CID105263051
Molecular FormulaC16H22N4O
Molecular Weight286.38 g/mol
Exact Mass286.18
IUPAC Name[1-(2,3-dihydro-1-benzofuran-2-yl)-2-(3-ethyl-1-methylpyrazol-5-yl)ethyl]hydrazine
SMILESCCc1cc(CC(NN)C2Cc3ccccc3O2)n(C)n1
InChIInChI=1S/C16H22N4O/c1-3-12-9-13(20(2)19-12)10-14(18-17)16-8-11-6-4-5-7-15(11)21-16/h4-7,9,14,16,18H,3,8,10,17H2,1-2H3
InChIKeyDJKLEVLKGHVQKE-UHFFFAOYSA-N
XLogP1.36
TPSA65.10 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.38
LogP ≤ 51.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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-2-yl)-2-(1-methylimidazol-2-yl)ethyl]hydrazine
CID 105263048
[1-(2,3-dihydro-1-benzofuran-2-yl)-3-(2-methylpyrazol-3-yl)propyl]hydrazine
CID 103025971
[1-(3,4-dihydro-2H-chromen-3-yl)-2-(2,5-dimethylpyrazol-3-yl)ethyl]hydrazine
CID 105234006
1-(2,3-dihydro-1,4-benzoxathiin-2-yl)-2-(3-ethyl-1-methylpyrazol-5-yl)ethanamine
CID 106601395
[2-(3-ethyl-1-methylpyrazol-5-yl)-1-(2-ethyloxolan-3-yl)ethyl]hydrazine
CID 114104827
[1-(2,3-dihydro-1-benzofuran-2-yl)-3-methylbutyl]hydrazine
CID 105262824
[1-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)-2-(1,3-diethylpyrazol-5-yl)ethyl]hydrazine
CID 105224823
1-(2,3-dihydro-1-benzofuran-2-yl)heptylhydrazine
CID 105262982
1-(3-ethyl-1-methylpyrazol-5-yl)propan-2-ylhydrazine
CID 105201388
1-(2,3-dihydro-1-benzofuran-2-yl)-N-methyl-2-(1-methylpyrazol-3-yl)ethanamine
CID 82876393
1-(2,3-dihydro-1-benzothiophen-2-yl)-2-(3-ethyl-1-methylpyrazol-5-yl)ethanamine
CID 105160076
[1-(2,3-dihydro-1-benzofuran-2-yl)-3-methylbut-3-enyl]hydrazine
CID 105263013

Frequently Asked Questions

What is the IUPAC name of [1-(2,3-dihydro-1-benzofuran-2-yl)-2-(3-ethyl-1-methylpyrazol-5-yl)ethyl]hydrazine?
The IUPAC name of [1-(2,3-dihydro-1-benzofuran-2-yl)-2-(3-ethyl-1-methylpyrazol-5-yl)ethyl]hydrazine (CID 105263051) is [1-(2,3-dihydro-1-benzofuran-2-yl)-2-(3-ethyl-1-methylpyrazol-5-yl)ethyl]hydrazine.
What is the SMILES notation for [1-(2,3-dihydro-1-benzofuran-2-yl)-2-(3-ethyl-1-methylpyrazol-5-yl)ethyl]hydrazine?
The canonical SMILES for [1-(2,3-dihydro-1-benzofuran-2-yl)-2-(3-ethyl-1-methylpyrazol-5-yl)ethyl]hydrazine is CCc1cc(CC(NN)C2Cc3ccccc3O2)n(C)n1.
What is the InChIKey of [1-(2,3-dihydro-1-benzofuran-2-yl)-2-(3-ethyl-1-methylpyrazol-5-yl)ethyl]hydrazine?
The InChIKey is DJKLEVLKGHVQKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N4O/c1-3-12-9-13(20(2)19-12)10-14(18-17)16-8-11-6-4-5-7-15(11)21-16/h4-7,9,14,16,18H,3,8,10,17H2,1-2H3.
What are the key properties of [1-(2,3-dihydro-1-benzofuran-2-yl)-2-(3-ethyl-1-methylpyrazol-5-yl)ethyl]hydrazine?
[1-(2,3-dihydro-1-benzofuran-2-yl)-2-(3-ethyl-1-methylpyrazol-5-yl)ethyl]hydrazine has a molecular weight of 286.38 g/mol, XLogP of 1.36, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2,3-dihydro-1-benzofuran-2-yl)-2-(3-ethyl-1-methylpyrazol-5-yl)ethyl]hydrazine is sourced from PubChem (CID 105263051), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).