5-butan-2-yl-2-cyclopropyl-2-methyl-1-(3-methylbutyl)piperazine

C17H34N2 — CID 64849427

IUPAC5-butan-2-yl-2-cyclopropyl-2-methyl-1-(3-methylbutyl)piperazine
SMILESCCC(C)C1CN(CCC(C)C)C(C)(C2CC2)CN1
InChIInChI=1S/C17H34N2/c1-6-14(4)16-11-19(10-9-13(2)3)17(5,12-18-16)15-7-8-15/h13-16,18H,6-12H2,1-5H3
InChIKeyUPLMNMARFIDHEX-UHFFFAOYSA-N
MW266.47 g/mol
LogP3.52
Rot. Bonds6

About 5-butan-2-yl-2-cyclopropyl-2-methyl-1-(3-methylbutyl)piperazine

5-butan-2-yl-2-cyclopropyl-2-methyl-1-(3-methylbutyl)piperazine (PubChem CID 64849427) has the molecular formula C17H34N2 and a molecular weight of 266.47 g/mol. Its IUPAC name is 5-butan-2-yl-2-cyclopropyl-2-methyl-1-(3-methylbutyl)piperazine.

Molecular Properties

Compound Name5-butan-2-yl-2-cyclopropyl-2-methyl-1-(3-methylbutyl)piperazine
PubChem CID64849427
Molecular FormulaC17H34N2
Molecular Weight266.47 g/mol
Exact Mass266.27
IUPAC Name5-butan-2-yl-2-cyclopropyl-2-methyl-1-(3-methylbutyl)piperazine
SMILESCCC(C)C1CN(CCC(C)C)C(C)(C2CC2)CN1
InChIInChI=1S/C17H34N2/c1-6-14(4)16-11-19(10-9-13(2)3)17(5,12-18-16)15-7-8-15/h13-16,18H,6-12H2,1-5H3
InChIKeyUPLMNMARFIDHEX-UHFFFAOYSA-N
XLogP3.52
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.47
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-butan-2-yl-2-cyclopropyl-1-ethyl-2-methylpiperazine
CID 64849041
5-butan-2-yl-2-cyclopropyl-1-(2-methoxyethyl)-2-methylpiperazine
CID 64848079
5-butan-2-yl-2-cyclopropyl-2-methyl-1-(2,2,2-trifluoroethyl)piperazine
CID 64847885
1-butyl-2-cyclopropyl-2-methyl-5-propan-2-ylpiperazine
CID 64838885
5-butan-2-yl-1,2,2-trimethylpiperazine
CID 64847098
2-cyclopropyl-1-(3-methoxypropyl)-2-methyl-5-propan-2-ylpiperazine
CID 64839471
5-butan-2-yl-2-ethyl-2-methyl-1-propylpiperazine
CID 64847681
5-butan-2-yl-1-(2-fluoroethyl)-2,2-dimethylpiperazine
CID 80696297
2-cyclopropyl-2-methyl-5-propan-2-yl-1-(2,2,2-trifluoroethyl)piperazine
CID 64839279
5-butan-2-yl-1-(cyclopropylmethyl)-2-ethyl-2-methylpiperazine
CID 64849416
2-cyclopropyl-1-hexyl-2-methyl-5-(2-methylpropyl)piperazine
CID 64849739
2-cyclopropyl-2,5-dimethyl-1-(2-methylbutyl)piperazine
CID 64844970

Frequently Asked Questions

What is the IUPAC name of 5-butan-2-yl-2-cyclopropyl-2-methyl-1-(3-methylbutyl)piperazine?
The IUPAC name of 5-butan-2-yl-2-cyclopropyl-2-methyl-1-(3-methylbutyl)piperazine (CID 64849427) is 5-butan-2-yl-2-cyclopropyl-2-methyl-1-(3-methylbutyl)piperazine.
What is the SMILES notation for 5-butan-2-yl-2-cyclopropyl-2-methyl-1-(3-methylbutyl)piperazine?
The canonical SMILES for 5-butan-2-yl-2-cyclopropyl-2-methyl-1-(3-methylbutyl)piperazine is CCC(C)C1CN(CCC(C)C)C(C)(C2CC2)CN1.
What is the InChIKey of 5-butan-2-yl-2-cyclopropyl-2-methyl-1-(3-methylbutyl)piperazine?
The InChIKey is UPLMNMARFIDHEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34N2/c1-6-14(4)16-11-19(10-9-13(2)3)17(5,12-18-16)15-7-8-15/h13-16,18H,6-12H2,1-5H3.
What are the key properties of 5-butan-2-yl-2-cyclopropyl-2-methyl-1-(3-methylbutyl)piperazine?
5-butan-2-yl-2-cyclopropyl-2-methyl-1-(3-methylbutyl)piperazine has a molecular weight of 266.47 g/mol, XLogP of 3.52, 6 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-cyclopropyl-2-methyl-1-(3-methylbutyl)piperazine is sourced from PubChem (CID 64849427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).