2,5-di(propan-2-yl)-1-pyridin-3-ylpiperazine

C15H25N3 — CID 64952663

IUPAC2,5-di(propan-2-yl)-1-pyridin-3-ylpiperazine
SMILESCC(C)C1CN(c2cccnc2)C(C(C)C)CN1
InChIInChI=1S/C15H25N3/c1-11(2)14-10-18(13-6-5-7-16-8-13)15(9-17-14)12(3)4/h5-8,11-12,14-15,17H,9-10H2,1-4H3
InChIKeyYNTZEGLIWBWTDX-UHFFFAOYSA-N
MW247.39 g/mol
LogP2.54
Rot. Bonds3

About 2,5-di(propan-2-yl)-1-pyridin-3-ylpiperazine

2,5-di(propan-2-yl)-1-pyridin-3-ylpiperazine (PubChem CID 64952663) has the molecular formula C15H25N3 and a molecular weight of 247.39 g/mol. Its IUPAC name is 2,5-di(propan-2-yl)-1-pyridin-3-ylpiperazine.

Molecular Properties

Compound Name2,5-di(propan-2-yl)-1-pyridin-3-ylpiperazine
PubChem CID64952663
Molecular FormulaC15H25N3
Molecular Weight247.39 g/mol
Exact Mass247.20
IUPAC Name2,5-di(propan-2-yl)-1-pyridin-3-ylpiperazine
SMILESCC(C)C1CN(c2cccnc2)C(C(C)C)CN1
InChIInChI=1S/C15H25N3/c1-11(2)14-10-18(13-6-5-7-16-8-13)15(9-17-14)12(3)4/h5-8,11-12,14-15,17H,9-10H2,1-4H3
InChIKeyYNTZEGLIWBWTDX-UHFFFAOYSA-N
XLogP2.54
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.39
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-butan-2-yl-2-propan-2-yl-1-pyridin-3-ylpiperazine
CID 64952069
2-phenyl-5-propan-2-yl-1-pyridin-3-ylpiperazine
CID 64952268
2,5-di(propan-2-yl)-1-(2-pyridin-3-ylethyl)piperazine
CID 64937734
1-(4-ethoxyphenyl)-2,5-di(propan-2-yl)piperazine
CID 64952074
1-(3-fluoro-4-methylphenyl)-2,5-di(propan-2-yl)piperazine
CID 64954088
3-(3-propan-2-ylpyrazolidin-1-yl)pyridine
CID 174792029
5-methyl-1-(5-methyl-3-pyridinyl)-2-propan-2-ylpiperazine
CID 107586964
(1R,4R)-2-pyridin-3-yl-2,5-diazabicyclo[2.2.1]heptane
CID 16748111
1-(2,4-dimethylphenyl)-2,5-di(propan-2-yl)piperazine
CID 64954676
2-ethyl-5-propan-2-yl-1-(pyridin-3-ylmethyl)piperazine
CID 64831744
5-butan-2-yl-1-(3-chlorophenyl)-2-propan-2-ylpiperazine
CID 64936927
5-ethyl-1-phenyl-2-propan-2-ylpiperazine
CID 64930277

Frequently Asked Questions

What is the IUPAC name of 2,5-di(propan-2-yl)-1-pyridin-3-ylpiperazine?
The IUPAC name of 2,5-di(propan-2-yl)-1-pyridin-3-ylpiperazine (CID 64952663) is 2,5-di(propan-2-yl)-1-pyridin-3-ylpiperazine.
What is the SMILES notation for 2,5-di(propan-2-yl)-1-pyridin-3-ylpiperazine?
The canonical SMILES for 2,5-di(propan-2-yl)-1-pyridin-3-ylpiperazine is CC(C)C1CN(c2cccnc2)C(C(C)C)CN1.
What is the InChIKey of 2,5-di(propan-2-yl)-1-pyridin-3-ylpiperazine?
The InChIKey is YNTZEGLIWBWTDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3/c1-11(2)14-10-18(13-6-5-7-16-8-13)15(9-17-14)12(3)4/h5-8,11-12,14-15,17H,9-10H2,1-4H3.
What are the key properties of 2,5-di(propan-2-yl)-1-pyridin-3-ylpiperazine?
2,5-di(propan-2-yl)-1-pyridin-3-ylpiperazine has a molecular weight of 247.39 g/mol, XLogP of 2.54, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-di(propan-2-yl)-1-pyridin-3-ylpiperazine is sourced from PubChem (CID 64952663), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).