[2-(2-bicyclo[2.2.1]heptanyl)-1-(2,5-dichlorothiophen-3-yl)ethyl]hydrazine

C13H18Cl2N2S — CID 107970464

IUPAC[2-(2-bicyclo[2.2.1]heptanyl)-1-(2,5-dichlorothiophen-3-yl)ethyl]hydrazine
SMILESNNC(CC1CC2CCC1C2)c1cc(Cl)sc1Cl
InChIInChI=1S/C13H18Cl2N2S/c14-12-6-10(13(15)18-12)11(17-16)5-9-4-7-1-2-8(9)3-7/h6-9,11,17H,1-5,16H2
InChIKeyYAWBQQLYWOYPHL-UHFFFAOYSA-N
MW305.27 g/mol
LogP4.39
Rot. Bonds4

About [2-(2-bicyclo[2.2.1]heptanyl)-1-(2,5-dichlorothiophen-3-yl)ethyl]hydrazine

[2-(2-bicyclo[2.2.1]heptanyl)-1-(2,5-dichlorothiophen-3-yl)ethyl]hydrazine (PubChem CID 107970464) has the molecular formula C13H18Cl2N2S and a molecular weight of 305.27 g/mol. Its IUPAC name is [2-(2-bicyclo[2.2.1]heptanyl)-1-(2,5-dichlorothiophen-3-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(2-bicyclo[2.2.1]heptanyl)-1-(2,5-dichlorothiophen-3-yl)ethyl]hydrazine
PubChem CID107970464
Molecular FormulaC13H18Cl2N2S
Molecular Weight305.27 g/mol
Exact Mass304.06
IUPAC Name[2-(2-bicyclo[2.2.1]heptanyl)-1-(2,5-dichlorothiophen-3-yl)ethyl]hydrazine
SMILESNNC(CC1CC2CCC1C2)c1cc(Cl)sc1Cl
InChIInChI=1S/C13H18Cl2N2S/c14-12-6-10(13(15)18-12)11(17-16)5-9-4-7-1-2-8(9)3-7/h6-9,11,17H,1-5,16H2
InChIKeyYAWBQQLYWOYPHL-UHFFFAOYSA-N
XLogP4.39
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.27
LogP ≤ 54.39
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-(2-bicyclo[2.2.1]heptanyl)-1-(2-chloro-4-fluorophenyl)ethyl]hydrazine
CID 105215533
[1-(2,5-dichlorothiophen-3-yl)-2-(oxan-4-yl)ethyl]hydrazine
CID 107970203
3-[2-bicyclo[2.2.1]heptanyl(chloro)methyl]-2,5-dichlorothiophene
CID 63436563
[3-cyclopropyl-1-(2,5-dichlorothiophen-3-yl)propyl]hydrazine
CID 107970378
[2-(2-bicyclo[2.2.1]heptanyl)-1-(4-bromothiophen-2-yl)ethyl]hydrazine
CID 105222665
[1-(1-benzothiophen-3-yl)-2-(2-bicyclo[2.2.1]heptanyl)ethyl]hydrazine
CID 105323555
[2-(2-bicyclo[2.2.1]heptanyl)-1-(5-chloro-1-benzofuran-2-yl)ethyl]hydrazine
CID 105338486
[2-(2-bicyclo[2.2.1]heptanyl)-1-(2,6-dimethylphenyl)ethyl]hydrazine
CID 114027392
[2-(2-bicyclo[2.2.1]heptanyl)-1-(3,5-dimethoxyphenyl)ethyl]hydrazine
CID 105323624
[1-(1-benzofuran-3-yl)-2-(2-bicyclo[2.2.1]heptanyl)ethyl]hydrazine
CID 105262571
[2-(2-bicyclo[2.2.1]heptanyl)-1-(3-ethyl-4-pyridinyl)ethyl]hydrazine
CID 105262326
[2-(2-bicyclo[2.2.1]heptanyl)-1-(5-methylfuran-2-yl)ethyl]hydrazine
CID 105323574

Frequently Asked Questions

What is the IUPAC name of [2-(2-bicyclo[2.2.1]heptanyl)-1-(2,5-dichlorothiophen-3-yl)ethyl]hydrazine?
The IUPAC name of [2-(2-bicyclo[2.2.1]heptanyl)-1-(2,5-dichlorothiophen-3-yl)ethyl]hydrazine (CID 107970464) is [2-(2-bicyclo[2.2.1]heptanyl)-1-(2,5-dichlorothiophen-3-yl)ethyl]hydrazine.
What is the SMILES notation for [2-(2-bicyclo[2.2.1]heptanyl)-1-(2,5-dichlorothiophen-3-yl)ethyl]hydrazine?
The canonical SMILES for [2-(2-bicyclo[2.2.1]heptanyl)-1-(2,5-dichlorothiophen-3-yl)ethyl]hydrazine is NNC(CC1CC2CCC1C2)c1cc(Cl)sc1Cl.
What is the InChIKey of [2-(2-bicyclo[2.2.1]heptanyl)-1-(2,5-dichlorothiophen-3-yl)ethyl]hydrazine?
The InChIKey is YAWBQQLYWOYPHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18Cl2N2S/c14-12-6-10(13(15)18-12)11(17-16)5-9-4-7-1-2-8(9)3-7/h6-9,11,17H,1-5,16H2.
What are the key properties of [2-(2-bicyclo[2.2.1]heptanyl)-1-(2,5-dichlorothiophen-3-yl)ethyl]hydrazine?
[2-(2-bicyclo[2.2.1]heptanyl)-1-(2,5-dichlorothiophen-3-yl)ethyl]hydrazine has a molecular weight of 305.27 g/mol, XLogP of 4.39, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-bicyclo[2.2.1]heptanyl)-1-(2,5-dichlorothiophen-3-yl)ethyl]hydrazine is sourced from PubChem (CID 107970464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).