[1-(4-bromo-2-chlorophenyl)-3-(3-ethoxycyclobutyl)propan-2-yl]hydrazine

C15H22BrClN2O — CID 103170787

IUPAC[1-(4-bromo-2-chlorophenyl)-3-(3-ethoxycyclobutyl)propan-2-yl]hydrazine
SMILESCCOC1CC(CC(Cc2ccc(Br)cc2Cl)NN)C1
InChIInChI=1S/C15H22BrClN2O/c1-2-20-14-6-10(7-14)5-13(19-18)8-11-3-4-12(16)9-15(11)17/h3-4,9-10,13-14,19H,2,5-8,18H2,1H3
InChIKeyNPYQREYLTQVLTG-UHFFFAOYSA-N
MW361.71 g/mol
LogP3.68
Rot. Bonds7

About [1-(4-bromo-2-chlorophenyl)-3-(3-ethoxycyclobutyl)propan-2-yl]hydrazine

[1-(4-bromo-2-chlorophenyl)-3-(3-ethoxycyclobutyl)propan-2-yl]hydrazine (PubChem CID 103170787) has the molecular formula C15H22BrClN2O and a molecular weight of 361.71 g/mol. Its IUPAC name is [1-(4-bromo-2-chlorophenyl)-3-(3-ethoxycyclobutyl)propan-2-yl]hydrazine.

Molecular Properties

Compound Name[1-(4-bromo-2-chlorophenyl)-3-(3-ethoxycyclobutyl)propan-2-yl]hydrazine
PubChem CID103170787
Molecular FormulaC15H22BrClN2O
Molecular Weight361.71 g/mol
Exact Mass360.06
IUPAC Name[1-(4-bromo-2-chlorophenyl)-3-(3-ethoxycyclobutyl)propan-2-yl]hydrazine
SMILESCCOC1CC(CC(Cc2ccc(Br)cc2Cl)NN)C1
InChIInChI=1S/C15H22BrClN2O/c1-2-20-14-6-10(7-14)5-13(19-18)8-11-3-4-12(16)9-15(11)17/h3-4,9-10,13-14,19H,2,5-8,18H2,1H3
InChIKeyNPYQREYLTQVLTG-UHFFFAOYSA-N
XLogP3.68
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.71
LogP ≤ 53.68
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-bromophenyl)-3-(3-ethoxycyclobutyl)propan-2-yl]hydrazine
CID 103170381
[1-(5-chlorothiophen-2-yl)-3-(3-ethoxycyclobutyl)propan-2-yl]hydrazine
CID 103170459
[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-(4-bromo-2-chlorophenyl)-4-methoxybutan-2-yl]hydrazine
CID 105206418
1-(2,4-dichlorophenyl)-3-(3-ethoxycyclobutyl)propan-2-amine
CID 103168436
1-(4-bromo-2-chlorophenyl)octan-2-ylhydrazine
CID 105335285
[1-(2,6-dimethylphenyl)-3-(3-ethoxycyclobutyl)propan-2-yl]hydrazine
CID 103170731
ethyl 3-(4-bromo-2-chlorophenyl)-2-chloropropanoate
CID 83195199
[1-(4-bromo-2-chlorophenyl)-3-(2,5-dimethylphenyl)propan-2-yl]hydrazine
CID 105335288
1-(2-bromo-4-fluorophenyl)-3-(3-ethoxycyclobutyl)-N-methylpropan-2-amine
CID 103168471
[1-(4-bromo-2-chlorophenyl)-3-(3,5-difluorophenyl)propan-2-yl]hydrazine
CID 105206721

Frequently Asked Questions

What is the IUPAC name of [1-(4-bromo-2-chlorophenyl)-3-(3-ethoxycyclobutyl)propan-2-yl]hydrazine?
The IUPAC name of [1-(4-bromo-2-chlorophenyl)-3-(3-ethoxycyclobutyl)propan-2-yl]hydrazine (CID 103170787) is [1-(4-bromo-2-chlorophenyl)-3-(3-ethoxycyclobutyl)propan-2-yl]hydrazine.
What is the SMILES notation for [1-(4-bromo-2-chlorophenyl)-3-(3-ethoxycyclobutyl)propan-2-yl]hydrazine?
The canonical SMILES for [1-(4-bromo-2-chlorophenyl)-3-(3-ethoxycyclobutyl)propan-2-yl]hydrazine is CCOC1CC(CC(Cc2ccc(Br)cc2Cl)NN)C1.
What is the InChIKey of [1-(4-bromo-2-chlorophenyl)-3-(3-ethoxycyclobutyl)propan-2-yl]hydrazine?
The InChIKey is NPYQREYLTQVLTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22BrClN2O/c1-2-20-14-6-10(7-14)5-13(19-18)8-11-3-4-12(16)9-15(11)17/h3-4,9-10,13-14,19H,2,5-8,18H2,1H3.
What are the key properties of [1-(4-bromo-2-chlorophenyl)-3-(3-ethoxycyclobutyl)propan-2-yl]hydrazine?
[1-(4-bromo-2-chlorophenyl)-3-(3-ethoxycyclobutyl)propan-2-yl]hydrazine has a molecular weight of 361.71 g/mol, XLogP of 3.68, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(4-bromo-2-chlorophenyl)-3-(3-ethoxycyclobutyl)propan-2-yl]hydrazine is sourced from PubChem (CID 103170787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).