[1-(2,6-dimethylphenyl)-3-(3-ethoxycyclobutyl)propan-2-yl]hydrazine

C17H28N2O — CID 103170731

IUPAC[1-(2,6-dimethylphenyl)-3-(3-ethoxycyclobutyl)propan-2-yl]hydrazine
SMILESCCOC1CC(CC(Cc2c(C)cccc2C)NN)C1
InChIInChI=1S/C17H28N2O/c1-4-20-16-9-14(10-16)8-15(19-18)11-17-12(2)6-5-7-13(17)3/h5-7,14-16,19H,4,8-11,18H2,1-3H3
InChIKeySHFIIQKBWKFYFR-UHFFFAOYSA-N
MW276.42 g/mol
LogP2.88
Rot. Bonds7

About [1-(2,6-dimethylphenyl)-3-(3-ethoxycyclobutyl)propan-2-yl]hydrazine

[1-(2,6-dimethylphenyl)-3-(3-ethoxycyclobutyl)propan-2-yl]hydrazine (PubChem CID 103170731) has the molecular formula C17H28N2O and a molecular weight of 276.42 g/mol. Its IUPAC name is [1-(2,6-dimethylphenyl)-3-(3-ethoxycyclobutyl)propan-2-yl]hydrazine.

Molecular Properties

Compound Name[1-(2,6-dimethylphenyl)-3-(3-ethoxycyclobutyl)propan-2-yl]hydrazine
PubChem CID103170731
Molecular FormulaC17H28N2O
Molecular Weight276.42 g/mol
Exact Mass276.22
IUPAC Name[1-(2,6-dimethylphenyl)-3-(3-ethoxycyclobutyl)propan-2-yl]hydrazine
SMILESCCOC1CC(CC(Cc2c(C)cccc2C)NN)C1
InChIInChI=1S/C17H28N2O/c1-4-20-16-9-14(10-16)8-15(19-18)11-17-12(2)6-5-7-13(17)3/h5-7,14-16,19H,4,8-11,18H2,1-3H3
InChIKeySHFIIQKBWKFYFR-UHFFFAOYSA-N
XLogP2.88
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.42
LogP ≤ 52.88
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-ethoxycyclobutyl)-3-(2-methylphenyl)propan-2-yl]hydrazine
CID 103170384
[1-(3-ethoxycyclobutyl)-3-(3-methylphenyl)propan-2-yl]hydrazine
CID 103170383
[1-cyclobutyl-3-(2,6-dimethylphenyl)propan-2-yl]hydrazine
CID 103170732
[1-(3-bromophenyl)-3-(3-ethoxycyclobutyl)propan-2-yl]hydrazine
CID 103170381
[1-(2-bromo-3-fluorophenyl)-3-(3-ethoxycyclobutyl)propan-2-yl]hydrazine
CID 103170713
[1-(5-chlorothiophen-2-yl)-3-(3-ethoxycyclobutyl)propan-2-yl]hydrazine
CID 103170459
[1-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)-3-(3-ethoxycyclobutyl)propan-2-yl]hydrazine
CID 103170643
[1-(4-bromo-2-chlorophenyl)-3-(3-ethoxycyclobutyl)propan-2-yl]hydrazine
CID 103170787
1-(3-ethoxycyclobutyl)-N-methyl-3-(4-methylphenyl)propan-2-amine
CID 103164153
[1-(3-ethoxycyclobutyl)-3-(1-ethylimidazol-2-yl)propan-2-yl]hydrazine
CID 103170665
1-(2-chloro-6-fluorophenyl)-3-(3-ethoxycyclobutyl)-N-ethylpropan-2-amine
CID 103164119
1-(2,6-dimethylphenyl)decan-2-ylhydrazine
CID 105329203

Frequently Asked Questions

What is the IUPAC name of [1-(2,6-dimethylphenyl)-3-(3-ethoxycyclobutyl)propan-2-yl]hydrazine?
The IUPAC name of [1-(2,6-dimethylphenyl)-3-(3-ethoxycyclobutyl)propan-2-yl]hydrazine (CID 103170731) is [1-(2,6-dimethylphenyl)-3-(3-ethoxycyclobutyl)propan-2-yl]hydrazine.
What is the SMILES notation for [1-(2,6-dimethylphenyl)-3-(3-ethoxycyclobutyl)propan-2-yl]hydrazine?
The canonical SMILES for [1-(2,6-dimethylphenyl)-3-(3-ethoxycyclobutyl)propan-2-yl]hydrazine is CCOC1CC(CC(Cc2c(C)cccc2C)NN)C1.
What is the InChIKey of [1-(2,6-dimethylphenyl)-3-(3-ethoxycyclobutyl)propan-2-yl]hydrazine?
The InChIKey is SHFIIQKBWKFYFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N2O/c1-4-20-16-9-14(10-16)8-15(19-18)11-17-12(2)6-5-7-13(17)3/h5-7,14-16,19H,4,8-11,18H2,1-3H3.
What are the key properties of [1-(2,6-dimethylphenyl)-3-(3-ethoxycyclobutyl)propan-2-yl]hydrazine?
[1-(2,6-dimethylphenyl)-3-(3-ethoxycyclobutyl)propan-2-yl]hydrazine has a molecular weight of 276.42 g/mol, XLogP of 2.88, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2,6-dimethylphenyl)-3-(3-ethoxycyclobutyl)propan-2-yl]hydrazine is sourced from PubChem (CID 103170731), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).