[1-(3-bromophenyl)-3-(3-ethoxycyclobutyl)propan-2-yl]hydrazine

C15H23BrN2O — CID 103170381

IUPAC[1-(3-bromophenyl)-3-(3-ethoxycyclobutyl)propan-2-yl]hydrazine
SMILESCCOC1CC(CC(Cc2cccc(Br)c2)NN)C1
InChIInChI=1S/C15H23BrN2O/c1-2-19-15-9-12(10-15)8-14(18-17)7-11-4-3-5-13(16)6-11/h3-6,12,14-15,18H,2,7-10,17H2,1H3
InChIKeyDCXHWUNGCMIGET-UHFFFAOYSA-N
MW327.27 g/mol
LogP3.03
Rot. Bonds7

About [1-(3-bromophenyl)-3-(3-ethoxycyclobutyl)propan-2-yl]hydrazine

[1-(3-bromophenyl)-3-(3-ethoxycyclobutyl)propan-2-yl]hydrazine (PubChem CID 103170381) has the molecular formula C15H23BrN2O and a molecular weight of 327.27 g/mol. Its IUPAC name is [1-(3-bromophenyl)-3-(3-ethoxycyclobutyl)propan-2-yl]hydrazine.

Molecular Properties

Compound Name[1-(3-bromophenyl)-3-(3-ethoxycyclobutyl)propan-2-yl]hydrazine
PubChem CID103170381
Molecular FormulaC15H23BrN2O
Molecular Weight327.27 g/mol
Exact Mass326.10
IUPAC Name[1-(3-bromophenyl)-3-(3-ethoxycyclobutyl)propan-2-yl]hydrazine
SMILESCCOC1CC(CC(Cc2cccc(Br)c2)NN)C1
InChIInChI=1S/C15H23BrN2O/c1-2-19-15-9-12(10-15)8-14(18-17)7-11-4-3-5-13(16)6-11/h3-6,12,14-15,18H,2,7-10,17H2,1H3
InChIKeyDCXHWUNGCMIGET-UHFFFAOYSA-N
XLogP3.03
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.27
LogP ≤ 53.03
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-(3-methylphenyl)propan-2-yl]hydrazine
CID 103170383
[1-(4-bromo-2-chlorophenyl)-3-(3-ethoxycyclobutyl)propan-2-yl]hydrazine
CID 103170787
[1-(2,6-dimethylphenyl)-3-(3-ethoxycyclobutyl)propan-2-yl]hydrazine
CID 103170731
[1-(2-bromo-3-fluorophenyl)-3-(3-ethoxycyclobutyl)propan-2-yl]hydrazine
CID 103170713
[1-(3-ethoxycyclobutyl)-3-(2-methylphenyl)propan-2-yl]hydrazine
CID 103170384
1-(3-bromo-5-fluorophenyl)-3-(3-ethoxycyclobutyl)-N-ethylpropan-2-amine
CID 103169189
4-amino-3-(3-bromophenyl)-1-(3-ethoxycyclobutyl)butan-2-ol
CID 103167216
1-(3-ethoxycyclobutyl)-N-methyl-3-(4-methylphenyl)propan-2-amine
CID 103164153
[1-(3-bromophenyl)-4-methoxy-4-methylpentan-2-yl]hydrazine
CID 103025177
1-(3-bromophenyl)heptan-2-ylhydrazine
CID 105202849
[1-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)-3-(3-ethoxycyclobutyl)propan-2-yl]hydrazine
CID 103170643
1-(3-ethoxycyclobutyl)-3-phenylpropan-2-amine
CID 103164095

Frequently Asked Questions

What is the IUPAC name of [1-(3-bromophenyl)-3-(3-ethoxycyclobutyl)propan-2-yl]hydrazine?
The IUPAC name of [1-(3-bromophenyl)-3-(3-ethoxycyclobutyl)propan-2-yl]hydrazine (CID 103170381) is [1-(3-bromophenyl)-3-(3-ethoxycyclobutyl)propan-2-yl]hydrazine.
What is the SMILES notation for [1-(3-bromophenyl)-3-(3-ethoxycyclobutyl)propan-2-yl]hydrazine?
The canonical SMILES for [1-(3-bromophenyl)-3-(3-ethoxycyclobutyl)propan-2-yl]hydrazine is CCOC1CC(CC(Cc2cccc(Br)c2)NN)C1.
What is the InChIKey of [1-(3-bromophenyl)-3-(3-ethoxycyclobutyl)propan-2-yl]hydrazine?
The InChIKey is DCXHWUNGCMIGET-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23BrN2O/c1-2-19-15-9-12(10-15)8-14(18-17)7-11-4-3-5-13(16)6-11/h3-6,12,14-15,18H,2,7-10,17H2,1H3.
What are the key properties of [1-(3-bromophenyl)-3-(3-ethoxycyclobutyl)propan-2-yl]hydrazine?
[1-(3-bromophenyl)-3-(3-ethoxycyclobutyl)propan-2-yl]hydrazine has a molecular weight of 327.27 g/mol, XLogP of 3.03, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3-bromophenyl)-3-(3-ethoxycyclobutyl)propan-2-yl]hydrazine is sourced from PubChem (CID 103170381), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).