2-cyclopropyl-5,5-diethyl-1-(3-methylbutyl)piperazine

C16H32N2 — CID 64861980

IUPAC2-cyclopropyl-5,5-diethyl-1-(3-methylbutyl)piperazine
SMILESCCC1(CC)CN(CCC(C)C)C(C2CC2)CN1
InChIInChI=1S/C16H32N2/c1-5-16(6-2)12-18(10-9-13(3)4)15(11-17-16)14-7-8-14/h13-15,17H,5-12H2,1-4H3
InChIKeySBQWVEZFBQSROC-UHFFFAOYSA-N
MW252.45 g/mol
LogP3.28
Rot. Bonds6

About 2-cyclopropyl-5,5-diethyl-1-(3-methylbutyl)piperazine

2-cyclopropyl-5,5-diethyl-1-(3-methylbutyl)piperazine (PubChem CID 64861980) has the molecular formula C16H32N2 and a molecular weight of 252.45 g/mol. Its IUPAC name is 2-cyclopropyl-5,5-diethyl-1-(3-methylbutyl)piperazine.

Molecular Properties

Compound Name2-cyclopropyl-5,5-diethyl-1-(3-methylbutyl)piperazine
PubChem CID64861980
Molecular FormulaC16H32N2
Molecular Weight252.45 g/mol
Exact Mass252.26
IUPAC Name2-cyclopropyl-5,5-diethyl-1-(3-methylbutyl)piperazine
SMILESCCC1(CC)CN(CCC(C)C)C(C2CC2)CN1
InChIInChI=1S/C16H32N2/c1-5-16(6-2)12-18(10-9-13(3)4)15(11-17-16)14-7-8-14/h13-15,17H,5-12H2,1-4H3
InChIKeySBQWVEZFBQSROC-UHFFFAOYSA-N
XLogP3.28
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.45
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5,5-diethyl-2-methyl-1-(3-methylbutyl)piperazine
CID 64862336
2-cyclopropyl-5,5-diethyl-1-(2-methylsulfanylethyl)piperazine
CID 113474584
2-cyclopropyl-5,5-diethyl-1-(2-propylsulfonylethyl)piperazine
CID 106733248
2-cyclopropyl-1-(3-methylbutyl)piperazine
CID 64833359
2-cyclohexyl-1-(cyclopropylmethyl)-5,5-diethylpiperazine
CID 64860640
2-cyclopropyl-5,5-diethyl-1-[(1-methylpyrazol-4-yl)methyl]piperazine
CID 64861983
2-cyclopropyl-5,5-diethyl-1-[2-(1-methylpyrazol-4-yl)ethyl]piperazine
CID 103016627
2-cyclohexyl-5-ethyl-5-methyl-1-(4-methylpentyl)piperazine
CID 83148532
2-cyclohexyl-1-(2-ethoxyethyl)-5,5-diethylpiperazine
CID 64860257
2,5,5-triethyl-2-methyl-1-(3-methylbutyl)piperazine
CID 64860265
3-(5,5-diethyl-2-propan-2-ylpiperazin-1-yl)-1-azabicyclo[2.2.2]octane
CID 64932669
2-cyclopropyl-5,5-dimethyl-1-(2-methylpentyl)piperazine
CID 64839324

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-5,5-diethyl-1-(3-methylbutyl)piperazine?
The IUPAC name of 2-cyclopropyl-5,5-diethyl-1-(3-methylbutyl)piperazine (CID 64861980) is 2-cyclopropyl-5,5-diethyl-1-(3-methylbutyl)piperazine.
What is the SMILES notation for 2-cyclopropyl-5,5-diethyl-1-(3-methylbutyl)piperazine?
The canonical SMILES for 2-cyclopropyl-5,5-diethyl-1-(3-methylbutyl)piperazine is CCC1(CC)CN(CCC(C)C)C(C2CC2)CN1.
What is the InChIKey of 2-cyclopropyl-5,5-diethyl-1-(3-methylbutyl)piperazine?
The InChIKey is SBQWVEZFBQSROC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2/c1-5-16(6-2)12-18(10-9-13(3)4)15(11-17-16)14-7-8-14/h13-15,17H,5-12H2,1-4H3.
What are the key properties of 2-cyclopropyl-5,5-diethyl-1-(3-methylbutyl)piperazine?
2-cyclopropyl-5,5-diethyl-1-(3-methylbutyl)piperazine has a molecular weight of 252.45 g/mol, XLogP of 3.28, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-5,5-diethyl-1-(3-methylbutyl)piperazine is sourced from PubChem (CID 64861980), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).