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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Related Compounds

4-methyl-1,2-di(propan-2-yl)piperazine
CID 58964341
(2R)-4-benzhydryl-1,2-di(propan-2-yl)piperazine
CID 176877498
(2S)-1,2-di(propan-2-yl)pyrrolidine
CID 59966007
(2R)-1,2-di(propan-2-yl)pyrrolidine
CID 59965991
(2S)-1-butan-2-yl-2-(difluoromethyl)-4-propan-2-ylpiperazine
CID 176559079
1,2-di(propan-2-yl)azocane
CID 134605032
1,2,5-tri(propan-2-yl)azepane
CID 176801550
bis(1,4-di(propan-2-yl)azepane);bis(1,2-di(propan-2-yl)azetidine);bis(1,3-di(propan-2-yl)azetidine);1,4-di(propan-2-yl)piperazine;bis(1,2-di(propan-2-yl)piperidine);bis(1,3-di(propan-2-yl)piperidine);bis(1,4-di(propan-2-yl)piperidine);bis(1,2-di(propan-2-yl)pyrrolidine);bis(1,3-di(propan-2-yl)pyrrolidine);ethane;bis(1-methyl-2,4-di(propan-2-yl)piperazine);bis(4-methyl-1,2-di(propan-2-yl)piperazine)
CID 164980756
(2S)-2-(methoxymethyl)-1,4-di(propan-2-yl)piperazine
CID 169016330
6-fluoro-1,4-di(propan-2-yl)-1,4-diazepane
CID 153291266
1,2-di(propan-2-yl)-2,3,6,7-tetrahydroazepine
CID 59559506
2,7,8-tri(propan-2-yl)-2,8-diazaspiro[4.5]decane
CID 164847437

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).