3,5-dimethyl-1-(6-methylcyclohepta-1,6-dien-1-yl)piperazine

C14H24N2 — CID 123262129

IUPAC3,5-dimethyl-1-(6-methylcyclohepta-1,6-dien-1-yl)piperazine
SMILESCC1=CC(N2CC(C)NC(C)C2)=CCCC1
InChIInChI=1S/C14H24N2/c1-11-6-4-5-7-14(8-11)16-9-12(2)15-13(3)10-16/h7-8,12-13,15H,4-6,9-10H2,1-3H3
InChIKeyPRSDDKXASSDCLP-UHFFFAOYSA-N
MW220.36 g/mol
LogP2.68
Rot. Bonds1

About 3,5-dimethyl-1-(6-methylcyclohepta-1,6-dien-1-yl)piperazine

3,5-dimethyl-1-(6-methylcyclohepta-1,6-dien-1-yl)piperazine (PubChem CID 123262129) has the molecular formula C14H24N2 and a molecular weight of 220.36 g/mol. Its IUPAC name is 3,5-dimethyl-1-(6-methylcyclohepta-1,6-dien-1-yl)piperazine.

Molecular Properties

Compound Name3,5-dimethyl-1-(6-methylcyclohepta-1,6-dien-1-yl)piperazine
PubChem CID123262129
Molecular FormulaC14H24N2
Molecular Weight220.36 g/mol
Exact Mass220.19
IUPAC Name3,5-dimethyl-1-(6-methylcyclohepta-1,6-dien-1-yl)piperazine
SMILESCC1=CC(N2CC(C)NC(C)C2)=CCCC1
InChIInChI=1S/C14H24N2/c1-11-6-4-5-7-14(8-11)16-9-12(2)15-13(3)10-16/h7-8,12-13,15H,4-6,9-10H2,1-3H3
InChIKeyPRSDDKXASSDCLP-UHFFFAOYSA-N
XLogP2.68
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.36
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3,5-dimethyl-1-(6-methylcyclohepta-1,6-dien-1-yl)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 3,5-dimethyl-1-(6-methylcyclohepta-1,6-dien-1-yl)piperazine?
The IUPAC name of 3,5-dimethyl-1-(6-methylcyclohepta-1,6-dien-1-yl)piperazine (CID 123262129) is 3,5-dimethyl-1-(6-methylcyclohepta-1,6-dien-1-yl)piperazine.
What is the SMILES notation for 3,5-dimethyl-1-(6-methylcyclohepta-1,6-dien-1-yl)piperazine?
The canonical SMILES for 3,5-dimethyl-1-(6-methylcyclohepta-1,6-dien-1-yl)piperazine is CC1=CC(N2CC(C)NC(C)C2)=CCCC1.
What is the InChIKey of 3,5-dimethyl-1-(6-methylcyclohepta-1,6-dien-1-yl)piperazine?
The InChIKey is PRSDDKXASSDCLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2/c1-11-6-4-5-7-14(8-11)16-9-12(2)15-13(3)10-16/h7-8,12-13,15H,4-6,9-10H2,1-3H3.
What are the key properties of 3,5-dimethyl-1-(6-methylcyclohepta-1,6-dien-1-yl)piperazine?
3,5-dimethyl-1-(6-methylcyclohepta-1,6-dien-1-yl)piperazine has a molecular weight of 220.36 g/mol, XLogP of 2.68, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dimethyl-1-(6-methylcyclohepta-1,6-dien-1-yl)piperazine is sourced from PubChem (CID 123262129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).