[4-(oxolan-2-yl)-1-(2,4,6-trimethylphenyl)butyl]hydrazine

C17H28N2O — CID 105314099

IUPAC[4-(oxolan-2-yl)-1-(2,4,6-trimethylphenyl)butyl]hydrazine
SMILESCc1cc(C)c(C(CCCC2CCCO2)NN)c(C)c1
InChIInChI=1S/C17H28N2O/c1-12-10-13(2)17(14(3)11-12)16(19-18)8-4-6-15-7-5-9-20-15/h10-11,15-16,19H,4-9,18H2,1-3H3
InChIKeyJHVONFICYZHFGB-UHFFFAOYSA-N
MW276.42 g/mol
LogP3.47
Rot. Bonds6

About [4-(oxolan-2-yl)-1-(2,4,6-trimethylphenyl)butyl]hydrazine

[4-(oxolan-2-yl)-1-(2,4,6-trimethylphenyl)butyl]hydrazine (PubChem CID 105314099) has the molecular formula C17H28N2O and a molecular weight of 276.42 g/mol. Its IUPAC name is [4-(oxolan-2-yl)-1-(2,4,6-trimethylphenyl)butyl]hydrazine.

Molecular Properties

Compound Name[4-(oxolan-2-yl)-1-(2,4,6-trimethylphenyl)butyl]hydrazine
PubChem CID105314099
Molecular FormulaC17H28N2O
Molecular Weight276.42 g/mol
Exact Mass276.22
IUPAC Name[4-(oxolan-2-yl)-1-(2,4,6-trimethylphenyl)butyl]hydrazine
SMILESCc1cc(C)c(C(CCCC2CCCO2)NN)c(C)c1
InChIInChI=1S/C17H28N2O/c1-12-10-13(2)17(14(3)11-12)16(19-18)8-4-6-15-7-5-9-20-15/h10-11,15-16,19H,4-9,18H2,1-3H3
InChIKeyJHVONFICYZHFGB-UHFFFAOYSA-N
XLogP3.47
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.42
LogP ≤ 53.47
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-(3-bromo-4-methylphenyl)-4-(oxolan-2-yl)butyl]hydrazine
CID 105314055
[1-(3,5-dibromophenyl)-4-(oxolan-2-yl)butyl]hydrazine
CID 114023446
3-(oxolan-2-yl)-1-(2,4,6-trimethylphenyl)propan-1-ol
CID 65160613
[1-(2,3-dimethylphenyl)-4-(oxolan-2-yl)butyl]hydrazine
CID 105314004
[1-(2-ethyl-5-methylpyrazol-3-yl)-4-(oxolan-2-yl)butyl]hydrazine
CID 105314129
[4-(oxolan-2-yl)-1-pyrimidin-2-ylbutyl]hydrazine
CID 105203720
4-[1-hydrazinyl-4-(oxolan-2-yl)butyl]-N,N-dimethylaniline
CID 105314018
[1-(4-methyl-1,3-thiazol-5-yl)-4-(oxolan-2-yl)butyl]hydrazine
CID 105314053
[1-(4-bromothiophen-2-yl)-4-(oxolan-2-yl)butyl]hydrazine
CID 105222541
[4-(oxolan-2-yl)-1-quinoxalin-6-ylbutyl]hydrazine
CID 105221924
[1-(1,3-diethylpyrazol-5-yl)-4-(oxolan-2-yl)butyl]hydrazine
CID 105314095
1-(2,4-dimethylphenyl)-4-(oxolan-2-yl)butan-1-ol
CID 65161655

Frequently Asked Questions

What is the IUPAC name of [4-(oxolan-2-yl)-1-(2,4,6-trimethylphenyl)butyl]hydrazine?
The IUPAC name of [4-(oxolan-2-yl)-1-(2,4,6-trimethylphenyl)butyl]hydrazine (CID 105314099) is [4-(oxolan-2-yl)-1-(2,4,6-trimethylphenyl)butyl]hydrazine.
What is the SMILES notation for [4-(oxolan-2-yl)-1-(2,4,6-trimethylphenyl)butyl]hydrazine?
The canonical SMILES for [4-(oxolan-2-yl)-1-(2,4,6-trimethylphenyl)butyl]hydrazine is Cc1cc(C)c(C(CCCC2CCCO2)NN)c(C)c1.
What is the InChIKey of [4-(oxolan-2-yl)-1-(2,4,6-trimethylphenyl)butyl]hydrazine?
The InChIKey is JHVONFICYZHFGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N2O/c1-12-10-13(2)17(14(3)11-12)16(19-18)8-4-6-15-7-5-9-20-15/h10-11,15-16,19H,4-9,18H2,1-3H3.
What are the key properties of [4-(oxolan-2-yl)-1-(2,4,6-trimethylphenyl)butyl]hydrazine?
[4-(oxolan-2-yl)-1-(2,4,6-trimethylphenyl)butyl]hydrazine has a molecular weight of 276.42 g/mol, XLogP of 3.47, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(oxolan-2-yl)-1-(2,4,6-trimethylphenyl)butyl]hydrazine is sourced from PubChem (CID 105314099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).