1-(5-methoxy-2,2,4,4-tetramethylpentyl)piperazine

C14H30N2O — CID 135183061

IUPAC1-(5-methoxy-2,2,4,4-tetramethylpentyl)piperazine
SMILESCOCC(C)(C)CC(C)(C)CN1CCNCC1
InChIInChI=1S/C14H30N2O/c1-13(2,10-14(3,4)12-17-5)11-16-8-6-15-7-9-16/h15H,6-12H2,1-5H3
InChIKeyZMZSUTBVMLULAD-UHFFFAOYSA-N
MW242.41 g/mol
LogP1.98
Rot. Bonds6

About 1-(5-methoxy-2,2,4,4-tetramethylpentyl)piperazine

1-(5-methoxy-2,2,4,4-tetramethylpentyl)piperazine (PubChem CID 135183061) has the molecular formula C14H30N2O and a molecular weight of 242.41 g/mol. Its IUPAC name is 1-(5-methoxy-2,2,4,4-tetramethylpentyl)piperazine.

Molecular Properties

Compound Name1-(5-methoxy-2,2,4,4-tetramethylpentyl)piperazine
PubChem CID135183061
Molecular FormulaC14H30N2O
Molecular Weight242.41 g/mol
Exact Mass242.24
IUPAC Name1-(5-methoxy-2,2,4,4-tetramethylpentyl)piperazine
SMILESCOCC(C)(C)CC(C)(C)CN1CCNCC1
InChIInChI=1S/C14H30N2O/c1-13(2,10-14(3,4)12-17-5)11-16-8-6-15-7-9-16/h15H,6-12H2,1-5H3
InChIKeyZMZSUTBVMLULAD-UHFFFAOYSA-N
XLogP1.98
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.41
LogP ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(5-methoxy-2,2,4,4-tetramethylpentyl)piperazine 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-(5-methoxy-2,2,4,4-tetramethylpentyl)piperazine?
The IUPAC name of 1-(5-methoxy-2,2,4,4-tetramethylpentyl)piperazine (CID 135183061) is 1-(5-methoxy-2,2,4,4-tetramethylpentyl)piperazine.
What is the SMILES notation for 1-(5-methoxy-2,2,4,4-tetramethylpentyl)piperazine?
The canonical SMILES for 1-(5-methoxy-2,2,4,4-tetramethylpentyl)piperazine is COCC(C)(C)CC(C)(C)CN1CCNCC1.
What is the InChIKey of 1-(5-methoxy-2,2,4,4-tetramethylpentyl)piperazine?
The InChIKey is ZMZSUTBVMLULAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2O/c1-13(2,10-14(3,4)12-17-5)11-16-8-6-15-7-9-16/h15H,6-12H2,1-5H3.
What are the key properties of 1-(5-methoxy-2,2,4,4-tetramethylpentyl)piperazine?
1-(5-methoxy-2,2,4,4-tetramethylpentyl)piperazine has a molecular weight of 242.41 g/mol, XLogP of 1.98, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-methoxy-2,2,4,4-tetramethylpentyl)piperazine is sourced from PubChem (CID 135183061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).