[1-(5-bromothiophen-2-yl)-3-cycloheptylpropan-2-yl]hydrazine

C14H23BrN2S — CID 105295656

IUPAC[1-(5-bromothiophen-2-yl)-3-cycloheptylpropan-2-yl]hydrazine
SMILESNNC(Cc1ccc(Br)s1)CC1CCCCCC1
InChIInChI=1S/C14H23BrN2S/c15-14-8-7-13(18-14)10-12(17-16)9-11-5-3-1-2-4-6-11/h7-8,11-12,17H,1-6,9-10,16H2
InChIKeyAICONRYEUXUHRZ-UHFFFAOYSA-N
MW331.32 g/mol
LogP4.25
Rot. Bonds5

About [1-(5-bromothiophen-2-yl)-3-cycloheptylpropan-2-yl]hydrazine

[1-(5-bromothiophen-2-yl)-3-cycloheptylpropan-2-yl]hydrazine (PubChem CID 105295656) has the molecular formula C14H23BrN2S and a molecular weight of 331.32 g/mol. Its IUPAC name is [1-(5-bromothiophen-2-yl)-3-cycloheptylpropan-2-yl]hydrazine.

Molecular Properties

Compound Name[1-(5-bromothiophen-2-yl)-3-cycloheptylpropan-2-yl]hydrazine
PubChem CID105295656
Molecular FormulaC14H23BrN2S
Molecular Weight331.32 g/mol
Exact Mass330.08
IUPAC Name[1-(5-bromothiophen-2-yl)-3-cycloheptylpropan-2-yl]hydrazine
SMILESNNC(Cc1ccc(Br)s1)CC1CCCCCC1
InChIInChI=1S/C14H23BrN2S/c15-14-8-7-13(18-14)10-12(17-16)9-11-5-3-1-2-4-6-11/h7-8,11-12,17H,1-6,9-10,16H2
InChIKeyAICONRYEUXUHRZ-UHFFFAOYSA-N
XLogP4.25
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.32
LogP ≤ 54.25
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-(5-bromothiophen-2-yl)-1-cyclopropylethyl]hydrazine
CID 105202339
[1-(4-bromothiophen-2-yl)-3-cyclopentylpropan-2-yl]hydrazine
CID 105299335
[1-(7-bicyclo[4.1.0]heptanyl)-2-(5-bromothiophen-2-yl)ethyl]hydrazine
CID 105295777
[1-(5-bromothiophen-2-yl)-4-methylpentan-2-yl]hydrazine
CID 105198819
[1-(3-bromothiophen-2-yl)-3-cyclohexylpropan-2-yl]hydrazine
CID 105299515
2-bromo-5-(3-chloro-2-cyclopentylpropyl)thiophene
CID 112570449
[1-(2-bromophenyl)-3-cyclobutylpropan-2-yl]hydrazine
CID 105214950
1,3-dicyclohexylpropan-2-ylhydrazine
CID 105296165
[1-(5-bromothiophen-2-yl)-4-methylsulfanylbutan-2-yl]hydrazine
CID 105295733
[2-(5-bromothiophen-2-yl)-1-(3-ethylcyclopentyl)ethyl]hydrazine
CID 105233392
[1-(5-bromothiophen-2-yl)-3-(2,6-dichlorophenyl)propan-2-yl]hydrazine
CID 105209681
[1-(5-bromothiophen-2-yl)-3-(2-fluorophenyl)propan-2-yl]hydrazine
CID 105206828

Frequently Asked Questions

What is the IUPAC name of [1-(5-bromothiophen-2-yl)-3-cycloheptylpropan-2-yl]hydrazine?
The IUPAC name of [1-(5-bromothiophen-2-yl)-3-cycloheptylpropan-2-yl]hydrazine (CID 105295656) is [1-(5-bromothiophen-2-yl)-3-cycloheptylpropan-2-yl]hydrazine.
What is the SMILES notation for [1-(5-bromothiophen-2-yl)-3-cycloheptylpropan-2-yl]hydrazine?
The canonical SMILES for [1-(5-bromothiophen-2-yl)-3-cycloheptylpropan-2-yl]hydrazine is NNC(Cc1ccc(Br)s1)CC1CCCCCC1.
What is the InChIKey of [1-(5-bromothiophen-2-yl)-3-cycloheptylpropan-2-yl]hydrazine?
The InChIKey is AICONRYEUXUHRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23BrN2S/c15-14-8-7-13(18-14)10-12(17-16)9-11-5-3-1-2-4-6-11/h7-8,11-12,17H,1-6,9-10,16H2.
What are the key properties of [1-(5-bromothiophen-2-yl)-3-cycloheptylpropan-2-yl]hydrazine?
[1-(5-bromothiophen-2-yl)-3-cycloheptylpropan-2-yl]hydrazine has a molecular weight of 331.32 g/mol, XLogP of 4.25, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(5-bromothiophen-2-yl)-3-cycloheptylpropan-2-yl]hydrazine is sourced from PubChem (CID 105295656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).