[2-(4-bromothiophen-2-yl)-1-(1-ethoxycycloheptyl)ethyl]hydrazine

C15H25BrN2OS — CID 105278505

IUPAC[2-(4-bromothiophen-2-yl)-1-(1-ethoxycycloheptyl)ethyl]hydrazine
SMILESCCOC1(C(Cc2cc(Br)cs2)NN)CCCCCC1
InChIInChI=1S/C15H25BrN2OS/c1-2-19-15(7-5-3-4-6-8-15)14(18-17)10-13-9-12(16)11-20-13/h9,11,14,18H,2-8,10,17H2,1H3
InChIKeyKJXNAUVGGHDFRY-UHFFFAOYSA-N
MW361.35 g/mol
LogP4.01
Rot. Bonds6

About [2-(4-bromothiophen-2-yl)-1-(1-ethoxycycloheptyl)ethyl]hydrazine

[2-(4-bromothiophen-2-yl)-1-(1-ethoxycycloheptyl)ethyl]hydrazine (PubChem CID 105278505) has the molecular formula C15H25BrN2OS and a molecular weight of 361.35 g/mol. Its IUPAC name is [2-(4-bromothiophen-2-yl)-1-(1-ethoxycycloheptyl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(4-bromothiophen-2-yl)-1-(1-ethoxycycloheptyl)ethyl]hydrazine
PubChem CID105278505
Molecular FormulaC15H25BrN2OS
Molecular Weight361.35 g/mol
Exact Mass360.09
IUPAC Name[2-(4-bromothiophen-2-yl)-1-(1-ethoxycycloheptyl)ethyl]hydrazine
SMILESCCOC1(C(Cc2cc(Br)cs2)NN)CCCCCC1
InChIInChI=1S/C15H25BrN2OS/c1-2-19-15(7-5-3-4-6-8-15)14(18-17)10-13-9-12(16)11-20-13/h9,11,14,18H,2-8,10,17H2,1H3
InChIKeyKJXNAUVGGHDFRY-UHFFFAOYSA-N
XLogP4.01
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.35
LogP ≤ 54.01
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

2-(4-bromothiophen-2-yl)-1-(1-ethoxycyclopentyl)ethanol
CID 116753085
[1-(1-ethoxycyclohexyl)-2-(5-ethylthiophen-2-yl)ethyl]hydrazine
CID 105276332
[2-(4-bromothiophen-2-yl)-1-(2-methyloxolan-2-yl)ethyl]hydrazine
CID 105250920
[1-(1-ethoxycyclohexyl)-2-(1,3-thiazol-2-yl)ethyl]hydrazine
CID 105276383
[2-(3,5-dimethylphenyl)-1-(1-ethoxycyclohexyl)ethyl]hydrazine
CID 105276272
[2-(3,5-difluorophenyl)-1-(1-ethoxycyclohexyl)ethyl]hydrazine
CID 105413025
[2-(2-bromo-4-fluorophenyl)-1-(1-ethoxycyclohexyl)ethyl]hydrazine
CID 105276277
[2-(2,6-dimethylphenyl)-1-(1-ethoxycyclohexyl)ethyl]hydrazine
CID 105276343
[2-(4-chlorophenyl)-1-(1-ethoxycycloheptyl)ethyl]hydrazine
CID 105278524
[2-(2,6-difluorophenyl)-1-(1-ethoxycyclohexyl)ethyl]hydrazine
CID 105276415
[2-(3-bromothiophen-2-yl)-1-(4-ethoxyoxan-4-yl)ethyl]hydrazine
CID 105276919
2-(4-bromothiophen-2-yl)-1-(1-methoxycyclopentyl)ethanol
CID 104610489

Frequently Asked Questions

What is the IUPAC name of [2-(4-bromothiophen-2-yl)-1-(1-ethoxycycloheptyl)ethyl]hydrazine?
The IUPAC name of [2-(4-bromothiophen-2-yl)-1-(1-ethoxycycloheptyl)ethyl]hydrazine (CID 105278505) is [2-(4-bromothiophen-2-yl)-1-(1-ethoxycycloheptyl)ethyl]hydrazine.
What is the SMILES notation for [2-(4-bromothiophen-2-yl)-1-(1-ethoxycycloheptyl)ethyl]hydrazine?
The canonical SMILES for [2-(4-bromothiophen-2-yl)-1-(1-ethoxycycloheptyl)ethyl]hydrazine is CCOC1(C(Cc2cc(Br)cs2)NN)CCCCCC1.
What is the InChIKey of [2-(4-bromothiophen-2-yl)-1-(1-ethoxycycloheptyl)ethyl]hydrazine?
The InChIKey is KJXNAUVGGHDFRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25BrN2OS/c1-2-19-15(7-5-3-4-6-8-15)14(18-17)10-13-9-12(16)11-20-13/h9,11,14,18H,2-8,10,17H2,1H3.
What are the key properties of [2-(4-bromothiophen-2-yl)-1-(1-ethoxycycloheptyl)ethyl]hydrazine?
[2-(4-bromothiophen-2-yl)-1-(1-ethoxycycloheptyl)ethyl]hydrazine has a molecular weight of 361.35 g/mol, XLogP of 4.01, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(4-bromothiophen-2-yl)-1-(1-ethoxycycloheptyl)ethyl]hydrazine is sourced from PubChem (CID 105278505), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).