1-(2-methoxycyclohexyl)-3-methylpiperazine

C12H24N2O — CID 106873271

IUPAC1-(2-methoxycyclohexyl)-3-methylpiperazine
SMILESCOC1CCCCC1N1CCNC(C)C1
InChIInChI=1S/C12H24N2O/c1-10-9-14(8-7-13-10)11-5-3-4-6-12(11)15-2/h10-13H,3-9H2,1-2H3
InChIKeyHDHKMCJAANCRGK-UHFFFAOYSA-N
MW212.34 g/mol
LogP1.24
Rot. Bonds2

About 1-(2-methoxycyclohexyl)-3-methylpiperazine

1-(2-methoxycyclohexyl)-3-methylpiperazine (PubChem CID 106873271) has the molecular formula C12H24N2O and a molecular weight of 212.34 g/mol. Its IUPAC name is 1-(2-methoxycyclohexyl)-3-methylpiperazine.

Molecular Properties

Compound Name1-(2-methoxycyclohexyl)-3-methylpiperazine
PubChem CID106873271
Molecular FormulaC12H24N2O
Molecular Weight212.34 g/mol
Exact Mass212.19
IUPAC Name1-(2-methoxycyclohexyl)-3-methylpiperazine
SMILESCOC1CCCCC1N1CCNC(C)C1
InChIInChI=1S/C12H24N2O/c1-10-9-14(8-7-13-10)11-5-3-4-6-12(11)15-2/h10-13H,3-9H2,1-2H3
InChIKeyHDHKMCJAANCRGK-UHFFFAOYSA-N
XLogP1.24
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.34
LogP ≤ 51.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(2-methoxycyclohexyl)-3-methylpiperazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxycyclohexyl)-3-methylpiperazine?
The IUPAC name of 1-(2-methoxycyclohexyl)-3-methylpiperazine (CID 106873271) is 1-(2-methoxycyclohexyl)-3-methylpiperazine.
What is the SMILES notation for 1-(2-methoxycyclohexyl)-3-methylpiperazine?
The canonical SMILES for 1-(2-methoxycyclohexyl)-3-methylpiperazine is COC1CCCCC1N1CCNC(C)C1.
What is the InChIKey of 1-(2-methoxycyclohexyl)-3-methylpiperazine?
The InChIKey is HDHKMCJAANCRGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O/c1-10-9-14(8-7-13-10)11-5-3-4-6-12(11)15-2/h10-13H,3-9H2,1-2H3.
What are the key properties of 1-(2-methoxycyclohexyl)-3-methylpiperazine?
1-(2-methoxycyclohexyl)-3-methylpiperazine has a molecular weight of 212.34 g/mol, XLogP of 1.24, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxycyclohexyl)-3-methylpiperazine is sourced from PubChem (CID 106873271), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).