5-butan-2-yl-2-ethyl-2-methyl-1-propylpiperazine

C14H30N2 — CID 64847681

IUPAC5-butan-2-yl-2-ethyl-2-methyl-1-propylpiperazine
SMILESCCCN1CC(C(C)CC)NCC1(C)CC
InChIInChI=1S/C14H30N2/c1-6-9-16-10-13(12(4)7-2)15-11-14(16,5)8-3/h12-13,15H,6-11H2,1-5H3
InChIKeyKAPDHGWOPSOFFB-UHFFFAOYSA-N
MW226.41 g/mol
LogP2.88
Rot. Bonds5

About 5-butan-2-yl-2-ethyl-2-methyl-1-propylpiperazine

5-butan-2-yl-2-ethyl-2-methyl-1-propylpiperazine (PubChem CID 64847681) has the molecular formula C14H30N2 and a molecular weight of 226.41 g/mol. Its IUPAC name is 5-butan-2-yl-2-ethyl-2-methyl-1-propylpiperazine.

Molecular Properties

Compound Name5-butan-2-yl-2-ethyl-2-methyl-1-propylpiperazine
PubChem CID64847681
Molecular FormulaC14H30N2
Molecular Weight226.41 g/mol
Exact Mass226.24
IUPAC Name5-butan-2-yl-2-ethyl-2-methyl-1-propylpiperazine
SMILESCCCN1CC(C(C)CC)NCC1(C)CC
InChIInChI=1S/C14H30N2/c1-6-9-16-10-13(12(4)7-2)15-11-14(16,5)8-3/h12-13,15H,6-11H2,1-5H3
InChIKeyKAPDHGWOPSOFFB-UHFFFAOYSA-N
XLogP2.88
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 ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 5-butan-2-yl-2-ethyl-2-methyl-1-propylpiperazine 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

5-butan-2-yl-2-ethyl-2-methyl-1-(2-methylbutyl)piperazine
CID 64848260
5-butan-2-yl-1-(cyclopropylmethyl)-2-ethyl-2-methylpiperazine
CID 64849416
5-butan-2-yl-2-ethyl-2-methyl-1-(2-pyrazol-1-ylethyl)piperazine
CID 64847296
5-butan-2-yl-1-(cyclobutylmethyl)-2-ethyl-2-methylpiperazine
CID 65462478
5-butan-2-yl-1-(3-chloro-2-methylprop-2-enyl)-2-ethyl-2-methylpiperazine
CID 106440446
5-butan-2-yl-2-ethyl-2-methyl-1-(2-thiophen-3-ylethyl)piperazine
CID 64847295
5-butan-2-yl-1,2,2-trimethylpiperazine
CID 64847098
5-butan-2-yl-1-(2-fluoroethyl)-2,2-dimethylpiperazine
CID 80696297
5-butan-2-yl-2-ethyl-2-methyl-1-(pyridin-3-ylmethyl)piperazine
CID 64849613
5-cyclopropyl-2-ethyl-2-methyl-1-propylpiperazine
CID 64862262
1-[(5-bromo-2-pyridinyl)methyl]-5-butan-2-yl-2-ethyl-2-methylpiperazine
CID 104812499
5-butan-2-yl-2-cyclopropyl-1-ethyl-2-methylpiperazine
CID 64849041

Frequently Asked Questions

What is the IUPAC name of 5-butan-2-yl-2-ethyl-2-methyl-1-propylpiperazine?
The IUPAC name of 5-butan-2-yl-2-ethyl-2-methyl-1-propylpiperazine (CID 64847681) is 5-butan-2-yl-2-ethyl-2-methyl-1-propylpiperazine.
What is the SMILES notation for 5-butan-2-yl-2-ethyl-2-methyl-1-propylpiperazine?
The canonical SMILES for 5-butan-2-yl-2-ethyl-2-methyl-1-propylpiperazine is CCCN1CC(C(C)CC)NCC1(C)CC.
What is the InChIKey of 5-butan-2-yl-2-ethyl-2-methyl-1-propylpiperazine?
The InChIKey is KAPDHGWOPSOFFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2/c1-6-9-16-10-13(12(4)7-2)15-11-14(16,5)8-3/h12-13,15H,6-11H2,1-5H3.
What are the key properties of 5-butan-2-yl-2-ethyl-2-methyl-1-propylpiperazine?
5-butan-2-yl-2-ethyl-2-methyl-1-propylpiperazine has a molecular weight of 226.41 g/mol, XLogP of 2.88, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-butan-2-yl-2-ethyl-2-methyl-1-propylpiperazine is sourced from PubChem (CID 64847681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).