1-butyl-2,5-diethyl-2,5-dimethylpiperazine

C14H30N2 — CID 64849689

IUPAC1-butyl-2,5-diethyl-2,5-dimethylpiperazine
SMILESCCCCN1CC(C)(CC)NCC1(C)CC
InChIInChI=1S/C14H30N2/c1-6-9-10-16-12-13(4,7-2)15-11-14(16,5)8-3/h15H,6-12H2,1-5H3
InChIKeyGTXGKHJAXIFTKI-UHFFFAOYSA-N
MW226.41 g/mol
LogP3.03
Rot. Bonds5

About 1-butyl-2,5-diethyl-2,5-dimethylpiperazine

1-butyl-2,5-diethyl-2,5-dimethylpiperazine (PubChem CID 64849689) has the molecular formula C14H30N2 and a molecular weight of 226.41 g/mol. Its IUPAC name is 1-butyl-2,5-diethyl-2,5-dimethylpiperazine.

Molecular Properties

Compound Name1-butyl-2,5-diethyl-2,5-dimethylpiperazine
PubChem CID64849689
Molecular FormulaC14H30N2
Molecular Weight226.41 g/mol
Exact Mass226.24
IUPAC Name1-butyl-2,5-diethyl-2,5-dimethylpiperazine
SMILESCCCCN1CC(C)(CC)NCC1(C)CC
InChIInChI=1S/C14H30N2/c1-6-9-10-16-12-13(4,7-2)15-11-14(16,5)8-3/h15H,6-12H2,1-5H3
InChIKeyGTXGKHJAXIFTKI-UHFFFAOYSA-N
XLogP3.03
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.41
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-butyl-2,5-diethyl-2,5-dimethylpiperazine with MolForge

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

Launch Full Analysis

Related Compounds

2,5-diethyl-1-(3-ethylsulfonylpropyl)-2,5-dimethylpiperazine
CID 65097597
2-ethyl-1-(3-ethylsulfonylpropyl)-2,5,5-trimethylpiperazine
CID 65097594
1-[(4-chlorophenyl)methyl]-2,5-diethyl-2,5-dimethylpiperazine
CID 64849867
2,5,5-triethyl-1-(3-ethylsulfonylpropyl)-2-methylpiperazine
CID 65097219
5-ethyl-2,2,5-trimethyl-1-(3-methylsulfonylpropyl)piperazine
CID 64849852
5-ethyl-1,2,2,5-tetramethylpiperazine
CID 64848331
1-[(2,6-dichlorophenyl)methyl]-2,5-diethyl-2,5-dimethylpiperazine
CID 64850045
8-ethyl-6-(3-fluoropropyl)-8-methyl-6,9-diazaspiro[4.5]decane
CID 81114319
1-[(3,4-dichlorophenyl)methyl]-2,5-diethyl-2,5-dimethylpiperazine
CID 64849861
2-cyclopropyl-5-ethyl-1-(3-fluoropropyl)-2,5-dimethylpiperazine
CID 81114433
2,5,5-triethyl-1-(2-fluoroethyl)-2-methylpiperazine
CID 80696303
5-[(2,5-diethyl-2,5-dimethylpiperazin-1-yl)methyl]-1,3-thiazole
CID 112644920

Frequently Asked Questions

What is the IUPAC name of 1-butyl-2,5-diethyl-2,5-dimethylpiperazine?
The IUPAC name of 1-butyl-2,5-diethyl-2,5-dimethylpiperazine (CID 64849689) is 1-butyl-2,5-diethyl-2,5-dimethylpiperazine.
What is the SMILES notation for 1-butyl-2,5-diethyl-2,5-dimethylpiperazine?
The canonical SMILES for 1-butyl-2,5-diethyl-2,5-dimethylpiperazine is CCCCN1CC(C)(CC)NCC1(C)CC.
What is the InChIKey of 1-butyl-2,5-diethyl-2,5-dimethylpiperazine?
The InChIKey is GTXGKHJAXIFTKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2/c1-6-9-10-16-12-13(4,7-2)15-11-14(16,5)8-3/h15H,6-12H2,1-5H3.
What are the key properties of 1-butyl-2,5-diethyl-2,5-dimethylpiperazine?
1-butyl-2,5-diethyl-2,5-dimethylpiperazine has a molecular weight of 226.41 g/mol, XLogP of 3.03, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-butyl-2,5-diethyl-2,5-dimethylpiperazine is sourced from PubChem (CID 64849689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).