1-butyl-2-cyclopropyl-2,5-dimethylpiperazine

C13H26N2 — CID 64844568

IUPAC1-butyl-2-cyclopropyl-2,5-dimethylpiperazine
SMILESCCCCN1CC(C)NCC1(C)C1CC1
InChIInChI=1S/C13H26N2/c1-4-5-8-15-9-11(2)14-10-13(15,3)12-6-7-12/h11-12,14H,4-10H2,1-3H3
InChIKeyAYOWYRAWTFVPMJ-UHFFFAOYSA-N
MW210.36 g/mol
LogP2.25
Rot. Bonds4

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

1-butyl-2-cyclopropyl-2,5-dimethylpiperazine (PubChem CID 64844568) has the molecular formula C13H26N2 and a molecular weight of 210.36 g/mol. Its IUPAC name is 1-butyl-2-cyclopropyl-2,5-dimethylpiperazine.

Molecular Properties

Compound Name1-butyl-2-cyclopropyl-2,5-dimethylpiperazine
PubChem CID64844568
Molecular FormulaC13H26N2
Molecular Weight210.36 g/mol
Exact Mass210.21
IUPAC Name1-butyl-2-cyclopropyl-2,5-dimethylpiperazine
SMILESCCCCN1CC(C)NCC1(C)C1CC1
InChIInChI=1S/C13H26N2/c1-4-5-8-15-9-11(2)14-10-13(15,3)12-6-7-12/h11-12,14H,4-10H2,1-3H3
InChIKeyAYOWYRAWTFVPMJ-UHFFFAOYSA-N
XLogP2.25
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.36
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-butyl-2-cyclopropyl-2-methyl-5-propylpiperazine
CID 64839603
1-butyl-2-cyclopropyl-2-methyl-5-propan-2-ylpiperazine
CID 64838885
2-cyclopropyl-2,5-dimethyl-1-(2-propoxyethyl)piperazine
CID 106458523
2-cyclopropyl-2,5-dimethyl-1-(3,3,3-trifluoropropyl)piperazine
CID 64843995
5-tert-butyl-2-cyclopropyl-1-heptyl-2-methylpiperazine
CID 64841098
2,2,5-trimethyl-1-pentylpiperazine
CID 64845904
2-cyclopropyl-1-hexyl-2-methyl-5-(2-methylpropyl)piperazine
CID 64849739
2-cyclopropyl-1,2,5-trimethylpiperazine
CID 64845552
2-cyclopropyl-2,5-dimethyl-1-(2-methylbutyl)piperazine
CID 64844970
2-cyclopropyl-2,5-dimethyl-1-(2-phenylethyl)piperazine
CID 64844387
1-[(E)-but-2-enyl]-2-cyclopropyl-2,5-dimethylpiperazine
CID 107897896
2-cyclopropyl-2-methyl-1-pentyl-5-phenylpiperazine
CID 64876131

Frequently Asked Questions

What is the IUPAC name of 1-butyl-2-cyclopropyl-2,5-dimethylpiperazine?
The IUPAC name of 1-butyl-2-cyclopropyl-2,5-dimethylpiperazine (CID 64844568) is 1-butyl-2-cyclopropyl-2,5-dimethylpiperazine.
What is the SMILES notation for 1-butyl-2-cyclopropyl-2,5-dimethylpiperazine?
The canonical SMILES for 1-butyl-2-cyclopropyl-2,5-dimethylpiperazine is CCCCN1CC(C)NCC1(C)C1CC1.
What is the InChIKey of 1-butyl-2-cyclopropyl-2,5-dimethylpiperazine?
The InChIKey is AYOWYRAWTFVPMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2/c1-4-5-8-15-9-11(2)14-10-13(15,3)12-6-7-12/h11-12,14H,4-10H2,1-3H3.
What are the key properties of 1-butyl-2-cyclopropyl-2,5-dimethylpiperazine?
1-butyl-2-cyclopropyl-2,5-dimethylpiperazine has a molecular weight of 210.36 g/mol, XLogP of 2.25, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-butyl-2-cyclopropyl-2,5-dimethylpiperazine is sourced from PubChem (CID 64844568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).