[(2-bromo-6-chlorophenyl)-(1-ethoxycyclopentyl)methyl]hydrazine

C14H20BrClN2O — CID 114269215

IUPAC[(2-bromo-6-chlorophenyl)-(1-ethoxycyclopentyl)methyl]hydrazine
SMILESCCOC1(C(NN)c2c(Cl)cccc2Br)CCCC1
InChIInChI=1S/C14H20BrClN2O/c1-2-19-14(8-3-4-9-14)13(18-17)12-10(15)6-5-7-11(12)16/h5-7,13,18H,2-4,8-9,17H2,1H3
InChIKeyBSIVRLNDDIEQIW-UHFFFAOYSA-N
MW347.68 g/mol
LogP3.96
Rot. Bonds5

About [(2-bromo-6-chlorophenyl)-(1-ethoxycyclopentyl)methyl]hydrazine

[(2-bromo-6-chlorophenyl)-(1-ethoxycyclopentyl)methyl]hydrazine (PubChem CID 114269215) has the molecular formula C14H20BrClN2O and a molecular weight of 347.68 g/mol. Its IUPAC name is [(2-bromo-6-chlorophenyl)-(1-ethoxycyclopentyl)methyl]hydrazine.

Molecular Properties

Compound Name[(2-bromo-6-chlorophenyl)-(1-ethoxycyclopentyl)methyl]hydrazine
PubChem CID114269215
Molecular FormulaC14H20BrClN2O
Molecular Weight347.68 g/mol
Exact Mass346.04
IUPAC Name[(2-bromo-6-chlorophenyl)-(1-ethoxycyclopentyl)methyl]hydrazine
SMILESCCOC1(C(NN)c2c(Cl)cccc2Br)CCCC1
InChIInChI=1S/C14H20BrClN2O/c1-2-19-14(8-3-4-9-14)13(18-17)12-10(15)6-5-7-11(12)16/h5-7,13,18H,2-4,8-9,17H2,1H3
InChIKeyBSIVRLNDDIEQIW-UHFFFAOYSA-N
XLogP3.96
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.68
LogP ≤ 53.96
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

[(2-chloro-5-fluorophenyl)-(1-ethoxycyclopentyl)methyl]hydrazine
CID 105397987
[(2-chloro-6-fluorophenyl)-(1-methoxycycloheptyl)methyl]hydrazine
CID 114275469
[(1-ethoxycyclohexyl)-(3-fluorophenyl)methyl]hydrazine
CID 105276324
N-[(2,3-dichlorophenyl)-(1-ethoxycyclopentyl)methyl]ethanamine
CID 116762307
[(2,3-dimethylphenyl)-(1-ethoxycyclohexyl)methyl]hydrazine
CID 105276240
1-(3-bromo-2-fluorophenyl)-1-(1-ethoxycyclohexyl)-N-methylmethanamine
CID 106646157
1-(3-bromo-2-fluorophenyl)-1-(1-ethoxycycloheptyl)-N-methylmethanamine
CID 106646181
3-[(1-ethoxycyclohexyl)-hydrazinylmethyl]-4-methylpyridin-2-amine
CID 105276403
[(4-chloro-2-fluorophenyl)-(1-ethoxycyclohexyl)methyl]hydrazine
CID 105276350
[2-(3-chloro-2-fluorophenyl)-1-(1-ethoxycyclohexyl)ethyl]hydrazine
CID 102868215
[(4-bromo-1-ethylpyrazol-5-yl)-(1-ethoxycyclohexyl)methyl]hydrazine
CID 105276358
[(3,5-dimethylphenyl)-(1-ethoxycycloheptyl)methyl]hydrazine
CID 105278518

Frequently Asked Questions

What is the IUPAC name of [(2-bromo-6-chlorophenyl)-(1-ethoxycyclopentyl)methyl]hydrazine?
The IUPAC name of [(2-bromo-6-chlorophenyl)-(1-ethoxycyclopentyl)methyl]hydrazine (CID 114269215) is [(2-bromo-6-chlorophenyl)-(1-ethoxycyclopentyl)methyl]hydrazine.
What is the SMILES notation for [(2-bromo-6-chlorophenyl)-(1-ethoxycyclopentyl)methyl]hydrazine?
The canonical SMILES for [(2-bromo-6-chlorophenyl)-(1-ethoxycyclopentyl)methyl]hydrazine is CCOC1(C(NN)c2c(Cl)cccc2Br)CCCC1.
What is the InChIKey of [(2-bromo-6-chlorophenyl)-(1-ethoxycyclopentyl)methyl]hydrazine?
The InChIKey is BSIVRLNDDIEQIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20BrClN2O/c1-2-19-14(8-3-4-9-14)13(18-17)12-10(15)6-5-7-11(12)16/h5-7,13,18H,2-4,8-9,17H2,1H3.
What are the key properties of [(2-bromo-6-chlorophenyl)-(1-ethoxycyclopentyl)methyl]hydrazine?
[(2-bromo-6-chlorophenyl)-(1-ethoxycyclopentyl)methyl]hydrazine has a molecular weight of 347.68 g/mol, XLogP of 3.96, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(2-bromo-6-chlorophenyl)-(1-ethoxycyclopentyl)methyl]hydrazine is sourced from PubChem (CID 114269215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).