[1-(5-chlorothiophen-2-yl)-3-ethoxy-3-ethylpentan-2-yl]hydrazine

C13H23ClN2OS — CID 105275195

IUPAC[1-(5-chlorothiophen-2-yl)-3-ethoxy-3-ethylpentan-2-yl]hydrazine
SMILESCCOC(CC)(CC)C(Cc1ccc(Cl)s1)NN
InChIInChI=1S/C13H23ClN2OS/c1-4-13(5-2,17-6-3)11(16-15)9-10-7-8-12(14)18-10/h7-8,11,16H,4-6,9,15H2,1-3H3
InChIKeyKANASTJAFXNFAH-UHFFFAOYSA-N
MW290.86 g/mol
LogP3.37
Rot. Bonds8

About [1-(5-chlorothiophen-2-yl)-3-ethoxy-3-ethylpentan-2-yl]hydrazine

[1-(5-chlorothiophen-2-yl)-3-ethoxy-3-ethylpentan-2-yl]hydrazine (PubChem CID 105275195) has the molecular formula C13H23ClN2OS and a molecular weight of 290.86 g/mol. Its IUPAC name is [1-(5-chlorothiophen-2-yl)-3-ethoxy-3-ethylpentan-2-yl]hydrazine.

Molecular Properties

Compound Name[1-(5-chlorothiophen-2-yl)-3-ethoxy-3-ethylpentan-2-yl]hydrazine
PubChem CID105275195
Molecular FormulaC13H23ClN2OS
Molecular Weight290.86 g/mol
Exact Mass290.12
IUPAC Name[1-(5-chlorothiophen-2-yl)-3-ethoxy-3-ethylpentan-2-yl]hydrazine
SMILESCCOC(CC)(CC)C(Cc1ccc(Cl)s1)NN
InChIInChI=1S/C13H23ClN2OS/c1-4-13(5-2,17-6-3)11(16-15)9-10-7-8-12(14)18-10/h7-8,11,16H,4-6,9,15H2,1-3H3
InChIKeyKANASTJAFXNFAH-UHFFFAOYSA-N
XLogP3.37
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.86
LogP ≤ 53.37
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-(5-chlorothiophen-2-yl)-3-ethyl-3-phenylpentan-2-yl]hydrazine
CID 105217759
1-(5-chlorothiophen-2-yl)-3-ethoxy-3-methylpentan-2-amine
CID 116758497
3-(5-chlorothiophen-2-yl)-N-ethyl-1,1,1-trifluoropropan-2-amine
CID 115841552
[3-ethoxy-3-ethyl-1-(1,3-thiazol-2-yl)pentan-2-yl]hydrazine
CID 105275180
[1-(3-bromothiophen-2-yl)-3-ethoxy-3-ethylpentan-2-yl]hydrazine
CID 105275170
[1-(5-chlorothiophen-2-yl)-3-methylbutan-2-yl]hydrazine
CID 105199674
[3-(5-chlorothiophen-2-yl)-1-ethoxy-1-phenylpropan-2-yl]hydrazine
CID 105279353
[1-(2-bromo-5-methoxyphenyl)-3-ethoxy-3-ethylpentan-2-yl]hydrazine
CID 105275091
[1-(5-chlorothiophen-2-yl)-4,5,5-trimethylhexan-2-yl]hydrazine
CID 105296073
[3-(5-ethylthiophen-2-yl)-1,1,1-trifluoropropan-2-yl]hydrazine
CID 105215725
ethyl 2-amino-3-(5-chlorothiophen-2-yl)propanoate
CID 62962765
3-(5-chlorothiophen-2-yl)-2-hydrazinyl-N,N-dimethylpropan-1-amine
CID 105244888

Frequently Asked Questions

What is the IUPAC name of [1-(5-chlorothiophen-2-yl)-3-ethoxy-3-ethylpentan-2-yl]hydrazine?
The IUPAC name of [1-(5-chlorothiophen-2-yl)-3-ethoxy-3-ethylpentan-2-yl]hydrazine (CID 105275195) is [1-(5-chlorothiophen-2-yl)-3-ethoxy-3-ethylpentan-2-yl]hydrazine.
What is the SMILES notation for [1-(5-chlorothiophen-2-yl)-3-ethoxy-3-ethylpentan-2-yl]hydrazine?
The canonical SMILES for [1-(5-chlorothiophen-2-yl)-3-ethoxy-3-ethylpentan-2-yl]hydrazine is CCOC(CC)(CC)C(Cc1ccc(Cl)s1)NN.
What is the InChIKey of [1-(5-chlorothiophen-2-yl)-3-ethoxy-3-ethylpentan-2-yl]hydrazine?
The InChIKey is KANASTJAFXNFAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23ClN2OS/c1-4-13(5-2,17-6-3)11(16-15)9-10-7-8-12(14)18-10/h7-8,11,16H,4-6,9,15H2,1-3H3.
What are the key properties of [1-(5-chlorothiophen-2-yl)-3-ethoxy-3-ethylpentan-2-yl]hydrazine?
[1-(5-chlorothiophen-2-yl)-3-ethoxy-3-ethylpentan-2-yl]hydrazine has a molecular weight of 290.86 g/mol, XLogP of 3.37, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(5-chlorothiophen-2-yl)-3-ethoxy-3-ethylpentan-2-yl]hydrazine is sourced from PubChem (CID 105275195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).