[(3-chlorothiophen-2-yl)-(4-ethylcyclohexyl)methyl]hydrazine

C13H21ClN2S — CID 105313020

IUPAC[(3-chlorothiophen-2-yl)-(4-ethylcyclohexyl)methyl]hydrazine
SMILESCCC1CCC(C(NN)c2sccc2Cl)CC1
InChIInChI=1S/C13H21ClN2S/c1-2-9-3-5-10(6-4-9)12(16-15)13-11(14)7-8-17-13/h7-10,12,16H,2-6,15H2,1H3
InChIKeyDZNDJHUNHZVVJO-UHFFFAOYSA-N
MW272.84 g/mol
LogP4.12
Rot. Bonds4

About [(3-chlorothiophen-2-yl)-(4-ethylcyclohexyl)methyl]hydrazine

[(3-chlorothiophen-2-yl)-(4-ethylcyclohexyl)methyl]hydrazine (PubChem CID 105313020) has the molecular formula C13H21ClN2S and a molecular weight of 272.84 g/mol. Its IUPAC name is [(3-chlorothiophen-2-yl)-(4-ethylcyclohexyl)methyl]hydrazine.

Molecular Properties

Compound Name[(3-chlorothiophen-2-yl)-(4-ethylcyclohexyl)methyl]hydrazine
PubChem CID105313020
Molecular FormulaC13H21ClN2S
Molecular Weight272.84 g/mol
Exact Mass272.11
IUPAC Name[(3-chlorothiophen-2-yl)-(4-ethylcyclohexyl)methyl]hydrazine
SMILESCCC1CCC(C(NN)c2sccc2Cl)CC1
InChIInChI=1S/C13H21ClN2S/c1-2-9-3-5-10(6-4-9)12(16-15)13-11(14)7-8-17-13/h7-10,12,16H,2-6,15H2,1H3
InChIKeyDZNDJHUNHZVVJO-UHFFFAOYSA-N
XLogP4.12
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.84
LogP ≤ 54.12
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

[(3-chlorothiophen-2-yl)-(3-methylcyclopentyl)methyl]hydrazine
CID 107362061
[(4-ethylcyclohexyl)-thiophen-2-ylmethyl]hydrazine
CID 105193634
[(3-chloro-4-methylphenyl)-(4-ethylcyclohexyl)methyl]hydrazine
CID 105313068
1-(3-chlorothiophen-2-yl)-2-cyclopropyl-N-ethylethanamine
CID 80529187
N-[(3-chlorothiophen-2-yl)-[4-(trifluoromethyl)cyclohexyl]methyl]ethanamine
CID 107361656
[(5-chlorofuran-2-yl)-(4-ethylcyclohexyl)methyl]hydrazine
CID 106694480
1-(3-chlorothiophen-2-yl)-1-cyclobutyl-N-methylmethanamine
CID 80529179
1-(3-chlorothiophen-2-yl)-2-cyclopentyl-N-ethylethanamine
CID 80528924
[(4-tert-butylphenyl)-(4-ethylcyclohexyl)methyl]hydrazine
CID 105231567
[(3-chlorothiophen-2-yl)-(5-methyloxolan-2-yl)methyl]hydrazine
CID 107362358
4-[(4-ethylcyclohexyl)-hydrazinylmethyl]-N,N-dimethylaniline
CID 105313006
1-(3-chlorothiophen-2-yl)-N-ethyl-2-(thian-4-yl)ethanamine
CID 107361859

Frequently Asked Questions

What is the IUPAC name of [(3-chlorothiophen-2-yl)-(4-ethylcyclohexyl)methyl]hydrazine?
The IUPAC name of [(3-chlorothiophen-2-yl)-(4-ethylcyclohexyl)methyl]hydrazine (CID 105313020) is [(3-chlorothiophen-2-yl)-(4-ethylcyclohexyl)methyl]hydrazine.
What is the SMILES notation for [(3-chlorothiophen-2-yl)-(4-ethylcyclohexyl)methyl]hydrazine?
The canonical SMILES for [(3-chlorothiophen-2-yl)-(4-ethylcyclohexyl)methyl]hydrazine is CCC1CCC(C(NN)c2sccc2Cl)CC1.
What is the InChIKey of [(3-chlorothiophen-2-yl)-(4-ethylcyclohexyl)methyl]hydrazine?
The InChIKey is DZNDJHUNHZVVJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21ClN2S/c1-2-9-3-5-10(6-4-9)12(16-15)13-11(14)7-8-17-13/h7-10,12,16H,2-6,15H2,1H3.
What are the key properties of [(3-chlorothiophen-2-yl)-(4-ethylcyclohexyl)methyl]hydrazine?
[(3-chlorothiophen-2-yl)-(4-ethylcyclohexyl)methyl]hydrazine has a molecular weight of 272.84 g/mol, XLogP of 4.12, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(3-chlorothiophen-2-yl)-(4-ethylcyclohexyl)methyl]hydrazine is sourced from PubChem (CID 105313020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).