5-methyl-1-(2-piperidin-1-ylethyl)-2-propan-2-ylpiperazine

C15H31N3 — CID 82245206

IUPAC5-methyl-1-(2-piperidin-1-ylethyl)-2-propan-2-ylpiperazine
SMILESCC1CN(CCN2CCCCC2)C(C(C)C)CN1
InChIInChI=1S/C15H31N3/c1-13(2)15-11-16-14(3)12-18(15)10-9-17-7-5-4-6-8-17/h13-16H,4-12H2,1-3H3
InChIKeyPSAZMYNPTXZGBY-UHFFFAOYSA-N
MW253.43 g/mol
LogP1.79
Rot. Bonds4

About 5-methyl-1-(2-piperidin-1-ylethyl)-2-propan-2-ylpiperazine

5-methyl-1-(2-piperidin-1-ylethyl)-2-propan-2-ylpiperazine (PubChem CID 82245206) has the molecular formula C15H31N3 and a molecular weight of 253.43 g/mol. Its IUPAC name is 5-methyl-1-(2-piperidin-1-ylethyl)-2-propan-2-ylpiperazine.

Molecular Properties

Compound Name5-methyl-1-(2-piperidin-1-ylethyl)-2-propan-2-ylpiperazine
PubChem CID82245206
Molecular FormulaC15H31N3
Molecular Weight253.43 g/mol
Exact Mass253.25
IUPAC Name5-methyl-1-(2-piperidin-1-ylethyl)-2-propan-2-ylpiperazine
SMILESCC1CN(CCN2CCCCC2)C(C(C)C)CN1
InChIInChI=1S/C15H31N3/c1-13(2)15-11-16-14(3)12-18(15)10-9-17-7-5-4-6-8-17/h13-16H,4-12H2,1-3H3
InChIKeyPSAZMYNPTXZGBY-UHFFFAOYSA-N
XLogP1.79
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.43
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-piperidin-1-ylethyl)-2,5-di(propan-2-yl)piperazine
CID 82249272
5-methyl-2-(2-methylpropyl)-1-(2-piperidin-1-ylethyl)piperazine
CID 82247109
1-but-3-ynyl-5-methyl-2-propan-2-ylpiperazine
CID 64939157
1-(cyclobutylmethyl)-5-methyl-2-propan-2-ylpiperazine
CID 64937495
5-methyl-2-propan-2-yl-1-(2,2,2-trifluoroethyl)piperazine
CID 64845880
5-methyl-1-[(1-methylcyclopentyl)methyl]-2-propan-2-ylpiperazine
CID 64936660
1-(2-butoxyethyl)-5-methyl-2-propan-2-ylpiperazine
CID 64845683
1-[(1-ethylpiperidin-4-yl)methyl]-5-methyl-2-propan-2-ylpiperazine
CID 64937578
2-benzyl-5-methyl-1-(2-pyrrolidin-1-ylethyl)piperazine
CID 82250163
3-methyl-1-(2-pyrrolidin-1-ylethyl)piperazine
CID 65448835
1-(2-methoxy-2-methylpropyl)-5-methyl-2-propan-2-ylpiperazine
CID 104766282
(2S,5S)-1-benzyl-5-methyl-2-propan-2-ylpiperazine
CID 46705371

Frequently Asked Questions

What is the IUPAC name of 5-methyl-1-(2-piperidin-1-ylethyl)-2-propan-2-ylpiperazine?
The IUPAC name of 5-methyl-1-(2-piperidin-1-ylethyl)-2-propan-2-ylpiperazine (CID 82245206) is 5-methyl-1-(2-piperidin-1-ylethyl)-2-propan-2-ylpiperazine.
What is the SMILES notation for 5-methyl-1-(2-piperidin-1-ylethyl)-2-propan-2-ylpiperazine?
The canonical SMILES for 5-methyl-1-(2-piperidin-1-ylethyl)-2-propan-2-ylpiperazine is CC1CN(CCN2CCCCC2)C(C(C)C)CN1.
What is the InChIKey of 5-methyl-1-(2-piperidin-1-ylethyl)-2-propan-2-ylpiperazine?
The InChIKey is PSAZMYNPTXZGBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31N3/c1-13(2)15-11-16-14(3)12-18(15)10-9-17-7-5-4-6-8-17/h13-16H,4-12H2,1-3H3.
What are the key properties of 5-methyl-1-(2-piperidin-1-ylethyl)-2-propan-2-ylpiperazine?
5-methyl-1-(2-piperidin-1-ylethyl)-2-propan-2-ylpiperazine has a molecular weight of 253.43 g/mol, XLogP of 1.79, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-1-(2-piperidin-1-ylethyl)-2-propan-2-ylpiperazine is sourced from PubChem (CID 82245206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).