5-tert-butyl-1-(1-cyclopropylpropan-2-yl)-2-propan-2-ylpiperazine

C17H34N2 — CID 64939505

IUPAC5-tert-butyl-1-(1-cyclopropylpropan-2-yl)-2-propan-2-ylpiperazine
SMILESCC(C)C1CNC(C(C)(C)C)CN1C(C)CC1CC1
InChIInChI=1S/C17H34N2/c1-12(2)15-10-18-16(17(4,5)6)11-19(15)13(3)9-14-7-8-14/h12-16,18H,7-11H2,1-6H3
InChIKeyPLYVSXAQXRSGST-UHFFFAOYSA-N
MW266.47 g/mol
LogP3.52
Rot. Bonds4

About 5-tert-butyl-1-(1-cyclopropylpropan-2-yl)-2-propan-2-ylpiperazine

5-tert-butyl-1-(1-cyclopropylpropan-2-yl)-2-propan-2-ylpiperazine (PubChem CID 64939505) has the molecular formula C17H34N2 and a molecular weight of 266.47 g/mol. Its IUPAC name is 5-tert-butyl-1-(1-cyclopropylpropan-2-yl)-2-propan-2-ylpiperazine.

Molecular Properties

Compound Name5-tert-butyl-1-(1-cyclopropylpropan-2-yl)-2-propan-2-ylpiperazine
PubChem CID64939505
Molecular FormulaC17H34N2
Molecular Weight266.47 g/mol
Exact Mass266.27
IUPAC Name5-tert-butyl-1-(1-cyclopropylpropan-2-yl)-2-propan-2-ylpiperazine
SMILESCC(C)C1CNC(C(C)(C)C)CN1C(C)CC1CC1
InChIInChI=1S/C17H34N2/c1-12(2)15-10-18-16(17(4,5)6)11-19(15)13(3)9-14-7-8-14/h12-16,18H,7-11H2,1-6H3
InChIKeyPLYVSXAQXRSGST-UHFFFAOYSA-N
XLogP3.52
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
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-tert-butyl-1-(1-methylsulfonylpropan-2-yl)-2-propan-2-ylpiperazine
CID 64940326
5-tert-butyl-1-(cyclopropylmethyl)-2-propan-2-ylpiperazine
CID 64842219
5-tert-butyl-1-[1-(furan-2-yl)propan-2-yl]-2-propan-2-ylpiperazine
CID 64947778
5-tert-butyl-2-propan-2-yl-1-(2,2,3,3-tetrafluoropropyl)piperazine
CID 106294168
5-tert-butyl-1-(1,3-dimethylpiperidin-4-yl)-2-propan-2-ylpiperazine
CID 114506170
5-tert-butyl-2-propan-2-yl-1-(4-propan-2-yloxybutyl)piperazine
CID 106008736
5-tert-butyl-2-methyl-1-propan-2-ylpiperazine
CID 64841228
1-(1-cyclopropylbutan-2-yl)-5-(2-methylpropyl)-2-propan-2-ylpiperazine
CID 64941639
1-(2-butoxyethyl)-5-tert-butyl-2-propan-2-ylpiperazine
CID 64842412
5-cyclopropyl-1-(1-methoxypropan-2-yl)-2-propan-2-ylpiperazine
CID 64932375
5-tert-butyl-2-methyl-1-(4,4,4-trifluorobutan-2-yl)piperazine
CID 114129890
5-tert-butyl-1-[2-(3-methoxypropoxy)ethyl]-2-propan-2-ylpiperazine
CID 103184526

Frequently Asked Questions

What is the IUPAC name of 5-tert-butyl-1-(1-cyclopropylpropan-2-yl)-2-propan-2-ylpiperazine?
The IUPAC name of 5-tert-butyl-1-(1-cyclopropylpropan-2-yl)-2-propan-2-ylpiperazine (CID 64939505) is 5-tert-butyl-1-(1-cyclopropylpropan-2-yl)-2-propan-2-ylpiperazine.
What is the SMILES notation for 5-tert-butyl-1-(1-cyclopropylpropan-2-yl)-2-propan-2-ylpiperazine?
The canonical SMILES for 5-tert-butyl-1-(1-cyclopropylpropan-2-yl)-2-propan-2-ylpiperazine is CC(C)C1CNC(C(C)(C)C)CN1C(C)CC1CC1.
What is the InChIKey of 5-tert-butyl-1-(1-cyclopropylpropan-2-yl)-2-propan-2-ylpiperazine?
The InChIKey is PLYVSXAQXRSGST-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34N2/c1-12(2)15-10-18-16(17(4,5)6)11-19(15)13(3)9-14-7-8-14/h12-16,18H,7-11H2,1-6H3.
What are the key properties of 5-tert-butyl-1-(1-cyclopropylpropan-2-yl)-2-propan-2-ylpiperazine?
5-tert-butyl-1-(1-cyclopropylpropan-2-yl)-2-propan-2-ylpiperazine has a molecular weight of 266.47 g/mol, XLogP of 3.52, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-tert-butyl-1-(1-cyclopropylpropan-2-yl)-2-propan-2-ylpiperazine is sourced from PubChem (CID 64939505), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).