[1,3-dihydro-2-benzofuran-5-yl(5-oxaspiro[3.5]nonan-8-yl)methyl]hydrazine

C17H24N2O2 — CID 105322181

IUPAC[1,3-dihydro-2-benzofuran-5-yl(5-oxaspiro[3.5]nonan-8-yl)methyl]hydrazine
SMILESNNC(c1ccc2c(c1)COC2)C1CCOC2(CCC2)C1
InChIInChI=1S/C17H24N2O2/c18-19-16(12-2-3-14-10-20-11-15(14)8-12)13-4-7-21-17(9-13)5-1-6-17/h2-3,8,13,16,19H,1,4-7,9-11,18H2
InChIKeySORLHAYCHJLJQA-UHFFFAOYSA-N
MW288.39 g/mol
LogP2.57
Rot. Bonds3

About [1,3-dihydro-2-benzofuran-5-yl(5-oxaspiro[3.5]nonan-8-yl)methyl]hydrazine

[1,3-dihydro-2-benzofuran-5-yl(5-oxaspiro[3.5]nonan-8-yl)methyl]hydrazine (PubChem CID 105322181) has the molecular formula C17H24N2O2 and a molecular weight of 288.39 g/mol. Its IUPAC name is [1,3-dihydro-2-benzofuran-5-yl(5-oxaspiro[3.5]nonan-8-yl)methyl]hydrazine.

Molecular Properties

Compound Name[1,3-dihydro-2-benzofuran-5-yl(5-oxaspiro[3.5]nonan-8-yl)methyl]hydrazine
PubChem CID105322181
Molecular FormulaC17H24N2O2
Molecular Weight288.39 g/mol
Exact Mass288.18
IUPAC Name[1,3-dihydro-2-benzofuran-5-yl(5-oxaspiro[3.5]nonan-8-yl)methyl]hydrazine
SMILESNNC(c1ccc2c(c1)COC2)C1CCOC2(CCC2)C1
InChIInChI=1S/C17H24N2O2/c18-19-16(12-2-3-14-10-20-11-15(14)8-12)13-4-7-21-17(9-13)5-1-6-17/h2-3,8,13,16,19H,1,4-7,9-11,18H2
InChIKeySORLHAYCHJLJQA-UHFFFAOYSA-N
XLogP2.57
TPSA56.51 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.39
LogP ≤ 52.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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

[(3,4-difluorophenyl)-(5-oxaspiro[3.5]nonan-8-yl)methyl]hydrazine
CID 105197240
[(3-chloro-4-iodophenyl)-(5-oxaspiro[3.5]nonan-8-yl)methyl]hydrazine
CID 103217634
3-[hydrazinyl(5-oxaspiro[3.5]nonan-8-yl)methyl]-N,N-dimethylaniline
CID 105322169
[(4-chlorophenyl)-(1,9-dioxaspiro[5.5]undecan-4-yl)methyl]hydrazine
CID 105193249
[furan-3-yl(1-oxaspiro[5.5]undecan-4-yl)methyl]hydrazine
CID 105221431
[(3,4-dimethylphenyl)-(2,6-dioxaspiro[4.5]decan-9-yl)methyl]hydrazine
CID 105325543
[6-oxaspiro[4.5]decan-9-yl(pyridin-3-yl)methyl]hydrazine
CID 105196290
[(3-fluoro-5-methylphenyl)-(6-oxaspiro[4.5]decan-9-yl)methyl]hydrazine
CID 105257533
[(2,5-dibromophenyl)-(5-oxaspiro[3.5]nonan-8-yl)methyl]hydrazine
CID 105322235
[(2,5-dimethylphenyl)-(5-oxaspiro[3.5]nonan-8-yl)methyl]hydrazine
CID 105322196
[(2-iodophenyl)-(5-oxaspiro[3.5]nonan-8-yl)methyl]hydrazine
CID 105322205
[(4-bromo-3-methylphenyl)-(2,6-dioxaspiro[4.5]decan-9-yl)methyl]hydrazine
CID 105325539

Frequently Asked Questions

What is the IUPAC name of [1,3-dihydro-2-benzofuran-5-yl(5-oxaspiro[3.5]nonan-8-yl)methyl]hydrazine?
The IUPAC name of [1,3-dihydro-2-benzofuran-5-yl(5-oxaspiro[3.5]nonan-8-yl)methyl]hydrazine (CID 105322181) is [1,3-dihydro-2-benzofuran-5-yl(5-oxaspiro[3.5]nonan-8-yl)methyl]hydrazine.
What is the SMILES notation for [1,3-dihydro-2-benzofuran-5-yl(5-oxaspiro[3.5]nonan-8-yl)methyl]hydrazine?
The canonical SMILES for [1,3-dihydro-2-benzofuran-5-yl(5-oxaspiro[3.5]nonan-8-yl)methyl]hydrazine is NNC(c1ccc2c(c1)COC2)C1CCOC2(CCC2)C1.
What is the InChIKey of [1,3-dihydro-2-benzofuran-5-yl(5-oxaspiro[3.5]nonan-8-yl)methyl]hydrazine?
The InChIKey is SORLHAYCHJLJQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O2/c18-19-16(12-2-3-14-10-20-11-15(14)8-12)13-4-7-21-17(9-13)5-1-6-17/h2-3,8,13,16,19H,1,4-7,9-11,18H2.
What are the key properties of [1,3-dihydro-2-benzofuran-5-yl(5-oxaspiro[3.5]nonan-8-yl)methyl]hydrazine?
[1,3-dihydro-2-benzofuran-5-yl(5-oxaspiro[3.5]nonan-8-yl)methyl]hydrazine has a molecular weight of 288.39 g/mol, XLogP of 2.57, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1,3-dihydro-2-benzofuran-5-yl(5-oxaspiro[3.5]nonan-8-yl)methyl]hydrazine is sourced from PubChem (CID 105322181), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).