1,2,4-tri(propan-2-yl)piperazine

C13H28N2 — CID 58977477

IUPAC1,2,4-tri(propan-2-yl)piperazine
SMILESCC(C)C1CN(C(C)C)CCN1C(C)C
InChIInChI=1S/C13H28N2/c1-10(2)13-9-14(11(3)4)7-8-15(13)12(5)6/h10-13H,7-9H2,1-6H3
InChIKeyRYCSNGLMUSBFSU-UHFFFAOYSA-N
MW212.38 g/mol
LogP2.45
Rot. Bonds3

About 1,2,4-tri(propan-2-yl)piperazine

1,2,4-tri(propan-2-yl)piperazine (PubChem CID 58977477) has the molecular formula C13H28N2 and a molecular weight of 212.38 g/mol. Its IUPAC name is 1,2,4-tri(propan-2-yl)piperazine.

Molecular Properties

Compound Name1,2,4-tri(propan-2-yl)piperazine
PubChem CID58977477
Molecular FormulaC13H28N2
Molecular Weight212.38 g/mol
Exact Mass212.23
IUPAC Name1,2,4-tri(propan-2-yl)piperazine
SMILESCC(C)C1CN(C(C)C)CCN1C(C)C
InChIInChI=1S/C13H28N2/c1-10(2)13-9-14(11(3)4)7-8-15(13)12(5)6/h10-13H,7-9H2,1-6H3
InChIKeyRYCSNGLMUSBFSU-UHFFFAOYSA-N
XLogP2.45
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.38
LogP ≤ 52.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1,2,4-tri(propan-2-yl)piperazine?
The IUPAC name of 1,2,4-tri(propan-2-yl)piperazine (CID 58977477) is 1,2,4-tri(propan-2-yl)piperazine.
What is the SMILES notation for 1,2,4-tri(propan-2-yl)piperazine?
The canonical SMILES for 1,2,4-tri(propan-2-yl)piperazine is CC(C)C1CN(C(C)C)CCN1C(C)C.
What is the InChIKey of 1,2,4-tri(propan-2-yl)piperazine?
The InChIKey is RYCSNGLMUSBFSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2/c1-10(2)13-9-14(11(3)4)7-8-15(13)12(5)6/h10-13H,7-9H2,1-6H3.
What are the key properties of 1,2,4-tri(propan-2-yl)piperazine?
1,2,4-tri(propan-2-yl)piperazine has a molecular weight of 212.38 g/mol, XLogP of 2.45, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,4-tri(propan-2-yl)piperazine is sourced from PubChem (CID 58977477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).