[1-(4-methylcyclohexyl)-2-propylsulfanylethyl]hydrazine

C12H26N2S — CID 105225779

IUPAC[1-(4-methylcyclohexyl)-2-propylsulfanylethyl]hydrazine
SMILESCCCSCC(NN)C1CCC(C)CC1
InChIInChI=1S/C12H26N2S/c1-3-8-15-9-12(14-13)11-6-4-10(2)5-7-11/h10-12,14H,3-9,13H2,1-2H3
InChIKeyPQBFFDXYDSMMMQ-UHFFFAOYSA-N
MW230.42 g/mol
LogP2.79
Rot. Bonds6

About [1-(4-methylcyclohexyl)-2-propylsulfanylethyl]hydrazine

[1-(4-methylcyclohexyl)-2-propylsulfanylethyl]hydrazine (PubChem CID 105225779) has the molecular formula C12H26N2S and a molecular weight of 230.42 g/mol. Its IUPAC name is [1-(4-methylcyclohexyl)-2-propylsulfanylethyl]hydrazine.

Molecular Properties

Compound Name[1-(4-methylcyclohexyl)-2-propylsulfanylethyl]hydrazine
PubChem CID105225779
Molecular FormulaC12H26N2S
Molecular Weight230.42 g/mol
Exact Mass230.18
IUPAC Name[1-(4-methylcyclohexyl)-2-propylsulfanylethyl]hydrazine
SMILESCCCSCC(NN)C1CCC(C)CC1
InChIInChI=1S/C12H26N2S/c1-3-8-15-9-12(14-13)11-6-4-10(2)5-7-11/h10-12,14H,3-9,13H2,1-2H3
InChIKeyPQBFFDXYDSMMMQ-UHFFFAOYSA-N
XLogP2.79
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.42
LogP ≤ 52.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of [1-(4-methylcyclohexyl)-2-propylsulfanylethyl]hydrazine?
The IUPAC name of [1-(4-methylcyclohexyl)-2-propylsulfanylethyl]hydrazine (CID 105225779) is [1-(4-methylcyclohexyl)-2-propylsulfanylethyl]hydrazine.
What is the SMILES notation for [1-(4-methylcyclohexyl)-2-propylsulfanylethyl]hydrazine?
The canonical SMILES for [1-(4-methylcyclohexyl)-2-propylsulfanylethyl]hydrazine is CCCSCC(NN)C1CCC(C)CC1.
What is the InChIKey of [1-(4-methylcyclohexyl)-2-propylsulfanylethyl]hydrazine?
The InChIKey is PQBFFDXYDSMMMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2S/c1-3-8-15-9-12(14-13)11-6-4-10(2)5-7-11/h10-12,14H,3-9,13H2,1-2H3.
What are the key properties of [1-(4-methylcyclohexyl)-2-propylsulfanylethyl]hydrazine?
[1-(4-methylcyclohexyl)-2-propylsulfanylethyl]hydrazine has a molecular weight of 230.42 g/mol, XLogP of 2.79, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(4-methylcyclohexyl)-2-propylsulfanylethyl]hydrazine is sourced from PubChem (CID 105225779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).