[2,3-dihydro-1-benzofuran-5-yl-(1,4-dimethyl-1,4-diazepan-2-yl)methyl]hydrazine

C16H26N4O — CID 105261360

IUPAC[2,3-dihydro-1-benzofuran-5-yl-(1,4-dimethyl-1,4-diazepan-2-yl)methyl]hydrazine
SMILESCN1CCCN(C)C(C(NN)c2ccc3c(c2)CCO3)C1
InChIInChI=1S/C16H26N4O/c1-19-7-3-8-20(2)14(11-19)16(18-17)13-4-5-15-12(10-13)6-9-21-15/h4-5,10,14,16,18H,3,6-9,11,17H2,1-2H3
InChIKeyYJLOAWYGMSMKOW-UHFFFAOYSA-N
MW290.41 g/mol
LogP0.76
Rot. Bonds3

About [2,3-dihydro-1-benzofuran-5-yl-(1,4-dimethyl-1,4-diazepan-2-yl)methyl]hydrazine

[2,3-dihydro-1-benzofuran-5-yl-(1,4-dimethyl-1,4-diazepan-2-yl)methyl]hydrazine (PubChem CID 105261360) has the molecular formula C16H26N4O and a molecular weight of 290.41 g/mol. Its IUPAC name is [2,3-dihydro-1-benzofuran-5-yl-(1,4-dimethyl-1,4-diazepan-2-yl)methyl]hydrazine.

Molecular Properties

Compound Name[2,3-dihydro-1-benzofuran-5-yl-(1,4-dimethyl-1,4-diazepan-2-yl)methyl]hydrazine
PubChem CID105261360
Molecular FormulaC16H26N4O
Molecular Weight290.41 g/mol
Exact Mass290.21
IUPAC Name[2,3-dihydro-1-benzofuran-5-yl-(1,4-dimethyl-1,4-diazepan-2-yl)methyl]hydrazine
SMILESCN1CCCN(C)C(C(NN)c2ccc3c(c2)CCO3)C1
InChIInChI=1S/C16H26N4O/c1-19-7-3-8-20(2)14(11-19)16(18-17)13-4-5-15-12(10-13)6-9-21-15/h4-5,10,14,16,18H,3,6-9,11,17H2,1-2H3
InChIKeyYJLOAWYGMSMKOW-UHFFFAOYSA-N
XLogP0.76
TPSA53.76 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 50.76
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

[(4-chlorophenyl)-(1,4-dimethyl-1,4-diazepan-2-yl)methyl]hydrazine
CID 105261246
[(1,4-dimethyl-1,4-diazepan-2-yl)-(3,5-dimethylphenyl)methyl]hydrazine
CID 105261347
[2,3-dihydro-1-benzofuran-5-yl-(4-propan-2-ylcyclohexyl)methyl]hydrazine
CID 105232601
[7-bicyclo[4.2.0]octa-1,3,5-trienyl(2,3-dihydro-1-benzofuran-5-yl)methyl]hydrazine
CID 105224868
[2,3-dihydro-1-benzofuran-5-yl-(3-methyloxolan-2-yl)methyl]hydrazine
CID 105333925
[(1,4-dimethylpiperazin-2-yl)-(4-methylphenyl)methyl]hydrazine
CID 105247203
[(4-tert-butylphenyl)-(1,4-dimethylpiperazin-2-yl)methyl]hydrazine
CID 105247429
4-[2,3-dihydro-1-benzofuran-5-yl(methylamino)methyl]cyclohexan-1-amine
CID 116952305
N-[1-(2,3-dihydro-1-benzofuran-5-yl)ethyl]cyclopropanamine
CID 43754666
1-(2,3-dihydro-1-benzofuran-5-yl)-N,N'-dimethylmethanediamine
CID 116954398
N-[1-(2,3-dihydro-1-benzofuran-5-yl)ethyl]cyclohexanamine
CID 43756029
1-(2,3-dihydro-1-benzofuran-5-yl)decylhydrazine
CID 105293354

Frequently Asked Questions

What is the IUPAC name of [2,3-dihydro-1-benzofuran-5-yl-(1,4-dimethyl-1,4-diazepan-2-yl)methyl]hydrazine?
The IUPAC name of [2,3-dihydro-1-benzofuran-5-yl-(1,4-dimethyl-1,4-diazepan-2-yl)methyl]hydrazine (CID 105261360) is [2,3-dihydro-1-benzofuran-5-yl-(1,4-dimethyl-1,4-diazepan-2-yl)methyl]hydrazine.
What is the SMILES notation for [2,3-dihydro-1-benzofuran-5-yl-(1,4-dimethyl-1,4-diazepan-2-yl)methyl]hydrazine?
The canonical SMILES for [2,3-dihydro-1-benzofuran-5-yl-(1,4-dimethyl-1,4-diazepan-2-yl)methyl]hydrazine is CN1CCCN(C)C(C(NN)c2ccc3c(c2)CCO3)C1.
What is the InChIKey of [2,3-dihydro-1-benzofuran-5-yl-(1,4-dimethyl-1,4-diazepan-2-yl)methyl]hydrazine?
The InChIKey is YJLOAWYGMSMKOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N4O/c1-19-7-3-8-20(2)14(11-19)16(18-17)13-4-5-15-12(10-13)6-9-21-15/h4-5,10,14,16,18H,3,6-9,11,17H2,1-2H3.
What are the key properties of [2,3-dihydro-1-benzofuran-5-yl-(1,4-dimethyl-1,4-diazepan-2-yl)methyl]hydrazine?
[2,3-dihydro-1-benzofuran-5-yl-(1,4-dimethyl-1,4-diazepan-2-yl)methyl]hydrazine has a molecular weight of 290.41 g/mol, XLogP of 0.76, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2,3-dihydro-1-benzofuran-5-yl-(1,4-dimethyl-1,4-diazepan-2-yl)methyl]hydrazine is sourced from PubChem (CID 105261360), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).