[1-(2,5-dichlorothiophen-3-yl)-2-(oxan-4-yl)ethyl]hydrazine

C11H16Cl2N2OS — CID 107970203

IUPAC[1-(2,5-dichlorothiophen-3-yl)-2-(oxan-4-yl)ethyl]hydrazine
SMILESNNC(CC1CCOCC1)c1cc(Cl)sc1Cl
InChIInChI=1S/C11H16Cl2N2OS/c12-10-6-8(11(13)17-10)9(15-14)5-7-1-3-16-4-2-7/h6-7,9,15H,1-5,14H2
InChIKeyNCYAXRXJXQZPPA-UHFFFAOYSA-N
MW295.24 g/mol
LogP3.38
Rot. Bonds4

About [1-(2,5-dichlorothiophen-3-yl)-2-(oxan-4-yl)ethyl]hydrazine

[1-(2,5-dichlorothiophen-3-yl)-2-(oxan-4-yl)ethyl]hydrazine (PubChem CID 107970203) has the molecular formula C11H16Cl2N2OS and a molecular weight of 295.24 g/mol. Its IUPAC name is [1-(2,5-dichlorothiophen-3-yl)-2-(oxan-4-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[1-(2,5-dichlorothiophen-3-yl)-2-(oxan-4-yl)ethyl]hydrazine
PubChem CID107970203
Molecular FormulaC11H16Cl2N2OS
Molecular Weight295.24 g/mol
Exact Mass294.04
IUPAC Name[1-(2,5-dichlorothiophen-3-yl)-2-(oxan-4-yl)ethyl]hydrazine
SMILESNNC(CC1CCOCC1)c1cc(Cl)sc1Cl
InChIInChI=1S/C11H16Cl2N2OS/c12-10-6-8(11(13)17-10)9(15-14)5-7-1-3-16-4-2-7/h6-7,9,15H,1-5,14H2
InChIKeyNCYAXRXJXQZPPA-UHFFFAOYSA-N
XLogP3.38
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.24
LogP ≤ 53.38
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

1-(2,5-dichlorothiophen-3-yl)-N-methyl-2-(oxan-4-yl)ethanamine
CID 107968191
1-(2,5-dichlorothiophen-3-yl)-N-ethyl-2-(oxan-4-yl)ethanamine
CID 107968196
[3-cyclopropyl-1-(2,5-dichlorothiophen-3-yl)propyl]hydrazine
CID 107970378
[1-(2-bromo-4-chlorophenyl)-2-(oxan-4-yl)ethyl]hydrazine
CID 107996948
[2-(2-bicyclo[2.2.1]heptanyl)-1-(2,5-dichlorothiophen-3-yl)ethyl]hydrazine
CID 107970464
[1-(2-chloro-3-methylphenyl)-2-(oxan-4-yl)ethyl]hydrazine
CID 105298897
[2-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)-1-(2,5-dichlorothiophen-3-yl)ethyl]hydrazine
CID 114022357
(2,5-dichlorothiophen-3-yl)-(oxolan-3-yl)methanamine
CID 61270857
1-(2,5-dichlorothiophen-3-yl)pent-4-enylhydrazine
CID 107970341
[1-(3-chloro-4-methylthiophen-2-yl)-2-(oxan-4-yl)ethyl]hydrazine
CID 103408526
[1-(2,5-dimethoxyphenyl)-2-(oxan-4-yl)ethyl]hydrazine
CID 105298736
[1-(2-methoxy-5-methylphenyl)-2-(oxan-4-yl)ethyl]hydrazine
CID 105298761

Frequently Asked Questions

What is the IUPAC name of [1-(2,5-dichlorothiophen-3-yl)-2-(oxan-4-yl)ethyl]hydrazine?
The IUPAC name of [1-(2,5-dichlorothiophen-3-yl)-2-(oxan-4-yl)ethyl]hydrazine (CID 107970203) is [1-(2,5-dichlorothiophen-3-yl)-2-(oxan-4-yl)ethyl]hydrazine.
What is the SMILES notation for [1-(2,5-dichlorothiophen-3-yl)-2-(oxan-4-yl)ethyl]hydrazine?
The canonical SMILES for [1-(2,5-dichlorothiophen-3-yl)-2-(oxan-4-yl)ethyl]hydrazine is NNC(CC1CCOCC1)c1cc(Cl)sc1Cl.
What is the InChIKey of [1-(2,5-dichlorothiophen-3-yl)-2-(oxan-4-yl)ethyl]hydrazine?
The InChIKey is NCYAXRXJXQZPPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16Cl2N2OS/c12-10-6-8(11(13)17-10)9(15-14)5-7-1-3-16-4-2-7/h6-7,9,15H,1-5,14H2.
What are the key properties of [1-(2,5-dichlorothiophen-3-yl)-2-(oxan-4-yl)ethyl]hydrazine?
[1-(2,5-dichlorothiophen-3-yl)-2-(oxan-4-yl)ethyl]hydrazine has a molecular weight of 295.24 g/mol, XLogP of 3.38, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2,5-dichlorothiophen-3-yl)-2-(oxan-4-yl)ethyl]hydrazine is sourced from PubChem (CID 107970203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).