2-cyclopropyl-2,5-dimethyl-1-(2-methylbutyl)piperazine

C14H28N2 — CID 64844970

IUPAC2-cyclopropyl-2,5-dimethyl-1-(2-methylbutyl)piperazine
SMILESCCC(C)CN1CC(C)NCC1(C)C1CC1
InChIInChI=1S/C14H28N2/c1-5-11(2)8-16-9-12(3)15-10-14(16,4)13-6-7-13/h11-13,15H,5-10H2,1-4H3
InChIKeyLXEDNFRKXBGMMM-UHFFFAOYSA-N
MW224.39 g/mol
LogP2.49
Rot. Bonds4

About 2-cyclopropyl-2,5-dimethyl-1-(2-methylbutyl)piperazine

2-cyclopropyl-2,5-dimethyl-1-(2-methylbutyl)piperazine (PubChem CID 64844970) has the molecular formula C14H28N2 and a molecular weight of 224.39 g/mol. Its IUPAC name is 2-cyclopropyl-2,5-dimethyl-1-(2-methylbutyl)piperazine.

Molecular Properties

Compound Name2-cyclopropyl-2,5-dimethyl-1-(2-methylbutyl)piperazine
PubChem CID64844970
Molecular FormulaC14H28N2
Molecular Weight224.39 g/mol
Exact Mass224.23
IUPAC Name2-cyclopropyl-2,5-dimethyl-1-(2-methylbutyl)piperazine
SMILESCCC(C)CN1CC(C)NCC1(C)C1CC1
InChIInChI=1S/C14H28N2/c1-5-11(2)8-16-9-12(3)15-10-14(16,4)13-6-7-13/h11-13,15H,5-10H2,1-4H3
InChIKeyLXEDNFRKXBGMMM-UHFFFAOYSA-N
XLogP2.49
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.39
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-2,5-dimethyl-1-(2-methylbutyl)piperazine?
The IUPAC name of 2-cyclopropyl-2,5-dimethyl-1-(2-methylbutyl)piperazine (CID 64844970) is 2-cyclopropyl-2,5-dimethyl-1-(2-methylbutyl)piperazine.
What is the SMILES notation for 2-cyclopropyl-2,5-dimethyl-1-(2-methylbutyl)piperazine?
The canonical SMILES for 2-cyclopropyl-2,5-dimethyl-1-(2-methylbutyl)piperazine is CCC(C)CN1CC(C)NCC1(C)C1CC1.
What is the InChIKey of 2-cyclopropyl-2,5-dimethyl-1-(2-methylbutyl)piperazine?
The InChIKey is LXEDNFRKXBGMMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2/c1-5-11(2)8-16-9-12(3)15-10-14(16,4)13-6-7-13/h11-13,15H,5-10H2,1-4H3.
What are the key properties of 2-cyclopropyl-2,5-dimethyl-1-(2-methylbutyl)piperazine?
2-cyclopropyl-2,5-dimethyl-1-(2-methylbutyl)piperazine has a molecular weight of 224.39 g/mol, XLogP of 2.49, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-2,5-dimethyl-1-(2-methylbutyl)piperazine is sourced from PubChem (CID 64844970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).