[2-ethyl-2-methoxy-1-(2-propan-2-yloxyphenyl)butyl]hydrazine

C16H28N2O2 — CID 105275460

IUPAC[2-ethyl-2-methoxy-1-(2-propan-2-yloxyphenyl)butyl]hydrazine
SMILESCCC(CC)(OC)C(NN)c1ccccc1OC(C)C
InChIInChI=1S/C16H28N2O2/c1-6-16(7-2,19-5)15(18-17)13-10-8-9-11-14(13)20-12(3)4/h8-12,15,18H,6-7,17H2,1-5H3
InChIKeyLIMGITSAKHGAEU-UHFFFAOYSA-N
MW280.41 g/mol
LogP3.18
Rot. Bonds8

About [2-ethyl-2-methoxy-1-(2-propan-2-yloxyphenyl)butyl]hydrazine

[2-ethyl-2-methoxy-1-(2-propan-2-yloxyphenyl)butyl]hydrazine (PubChem CID 105275460) has the molecular formula C16H28N2O2 and a molecular weight of 280.41 g/mol. Its IUPAC name is [2-ethyl-2-methoxy-1-(2-propan-2-yloxyphenyl)butyl]hydrazine.

Molecular Properties

Compound Name[2-ethyl-2-methoxy-1-(2-propan-2-yloxyphenyl)butyl]hydrazine
PubChem CID105275460
Molecular FormulaC16H28N2O2
Molecular Weight280.41 g/mol
Exact Mass280.22
IUPAC Name[2-ethyl-2-methoxy-1-(2-propan-2-yloxyphenyl)butyl]hydrazine
SMILESCCC(CC)(OC)C(NN)c1ccccc1OC(C)C
InChIInChI=1S/C16H28N2O2/c1-6-16(7-2,19-5)15(18-17)13-10-8-9-11-14(13)20-12(3)4/h8-12,15,18H,6-7,17H2,1-5H3
InChIKeyLIMGITSAKHGAEU-UHFFFAOYSA-N
XLogP3.18
TPSA56.51 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.41
LogP ≤ 53.18
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

[1-(2,3-dimethylphenyl)-2-ethyl-2-methoxybutyl]hydrazine
CID 105275305
[1-(2-propan-2-yloxyphenyl)-2-propan-2-ylsulfanylethyl]hydrazine
CID 105226155
1-(2-ethoxyphenyl)-N,2-diethyl-2-methoxybutan-1-amine
CID 116761098
2,2-dimethyl-1-(2-propan-2-yloxyphenyl)-N-propylbutan-1-amine
CID 105018405
[2-methoxy-1-(2-methoxyphenyl)-2-methylpropyl]hydrazine
CID 105245221
[(2-fluorophenyl)-(2-propan-2-yloxyphenyl)methyl]hydrazine
CID 105216890
[(4-fluorophenyl)-(2-propan-2-yloxyphenyl)methyl]hydrazine
CID 105192765
[2-phenyl-1-(2-propan-2-yloxyphenyl)ethyl]hydrazine
CID 105195296
[4-methoxy-1-(2-propan-2-yloxyphenyl)butyl]hydrazine
CID 105225070
[1-[2-(difluoromethoxy)phenyl]-2,2-dimethylpropyl]hydrazine
CID 105305256
[(2,3-dichlorophenyl)-(2-propan-2-yloxyphenyl)methyl]hydrazine
CID 105326117
3-hydrazinyl-N,N-dimethyl-3-(2-propan-2-yloxyphenyl)propan-1-amine
CID 105259287

Frequently Asked Questions

What is the IUPAC name of [2-ethyl-2-methoxy-1-(2-propan-2-yloxyphenyl)butyl]hydrazine?
The IUPAC name of [2-ethyl-2-methoxy-1-(2-propan-2-yloxyphenyl)butyl]hydrazine (CID 105275460) is [2-ethyl-2-methoxy-1-(2-propan-2-yloxyphenyl)butyl]hydrazine.
What is the SMILES notation for [2-ethyl-2-methoxy-1-(2-propan-2-yloxyphenyl)butyl]hydrazine?
The canonical SMILES for [2-ethyl-2-methoxy-1-(2-propan-2-yloxyphenyl)butyl]hydrazine is CCC(CC)(OC)C(NN)c1ccccc1OC(C)C.
What is the InChIKey of [2-ethyl-2-methoxy-1-(2-propan-2-yloxyphenyl)butyl]hydrazine?
The InChIKey is LIMGITSAKHGAEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N2O2/c1-6-16(7-2,19-5)15(18-17)13-10-8-9-11-14(13)20-12(3)4/h8-12,15,18H,6-7,17H2,1-5H3.
What are the key properties of [2-ethyl-2-methoxy-1-(2-propan-2-yloxyphenyl)butyl]hydrazine?
[2-ethyl-2-methoxy-1-(2-propan-2-yloxyphenyl)butyl]hydrazine has a molecular weight of 280.41 g/mol, XLogP of 3.18, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-ethyl-2-methoxy-1-(2-propan-2-yloxyphenyl)butyl]hydrazine is sourced from PubChem (CID 105275460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).