1-(2-methylpropyl)-4-(2-piperidin-2-ylethyl)piperazine

C15H31N3 — CID 62777599

IUPAC1-(2-methylpropyl)-4-(2-piperidin-2-ylethyl)piperazine
SMILESCC(C)CN1CCN(CCC2CCCCN2)CC1
InChIInChI=1S/C15H31N3/c1-14(2)13-18-11-9-17(10-12-18)8-6-15-5-3-4-7-16-15/h14-16H,3-13H2,1-2H3
InChIKeyRZIWSJSUHYEUDQ-UHFFFAOYSA-N
MW253.43 g/mol
LogP1.79
Rot. Bonds5

About 1-(2-methylpropyl)-4-(2-piperidin-2-ylethyl)piperazine

1-(2-methylpropyl)-4-(2-piperidin-2-ylethyl)piperazine (PubChem CID 62777599) has the molecular formula C15H31N3 and a molecular weight of 253.43 g/mol. Its IUPAC name is 1-(2-methylpropyl)-4-(2-piperidin-2-ylethyl)piperazine.

Molecular Properties

Compound Name1-(2-methylpropyl)-4-(2-piperidin-2-ylethyl)piperazine
PubChem CID62777599
Molecular FormulaC15H31N3
Molecular Weight253.43 g/mol
Exact Mass253.25
IUPAC Name1-(2-methylpropyl)-4-(2-piperidin-2-ylethyl)piperazine
SMILESCC(C)CN1CCN(CCC2CCCCN2)CC1
InChIInChI=1S/C15H31N3/c1-14(2)13-18-11-9-17(10-12-18)8-6-15-5-3-4-7-16-15/h14-16H,3-13H2,1-2H3
InChIKeyRZIWSJSUHYEUDQ-UHFFFAOYSA-N
XLogP1.79
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
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-ethyl-4-(2-piperidin-2-ylethyl)piperazine
CID 43149889
4-methyl-1-(2-piperidin-2-ylethyl)piperidine;dihydrochloride
CID 56831635
N,N-dimethyl-1-(2-piperidin-2-ylethyl)piperidin-4-amine
CID 43586097
(2S)-2-(3-methylbutyl)piperidine
CID 94379266
4-ethyl-4-methyl-1-(2-piperidin-2-ylethyl)piperidine
CID 55166220
2-[2-(2,5-dihydropyrrol-1-yl)ethyl]piperidine
CID 84657646
N,N-dimethyl-1-(2-pyrrolidin-2-ylethyl)piperidin-4-amine
CID 61364502
1-phenyl-4-(2-piperidin-2-ylethyl)piperazine
CID 43149880
[4-(2-methylpropyl)piperazin-1-yl]-[(2S)-piperidin-2-yl]methanone
CID 103813273
2-[2-(2-methylpyrrolidin-1-yl)ethyl]piperidine
CID 60973343
3-ethyl-1-(2-piperidin-2-ylethyl)piperidine
CID 43584590
1-(4-piperidin-2-ylbutyl)piperidine
CID 15057319

Frequently Asked Questions

What is the IUPAC name of 1-(2-methylpropyl)-4-(2-piperidin-2-ylethyl)piperazine?
The IUPAC name of 1-(2-methylpropyl)-4-(2-piperidin-2-ylethyl)piperazine (CID 62777599) is 1-(2-methylpropyl)-4-(2-piperidin-2-ylethyl)piperazine.
What is the SMILES notation for 1-(2-methylpropyl)-4-(2-piperidin-2-ylethyl)piperazine?
The canonical SMILES for 1-(2-methylpropyl)-4-(2-piperidin-2-ylethyl)piperazine is CC(C)CN1CCN(CCC2CCCCN2)CC1.
What is the InChIKey of 1-(2-methylpropyl)-4-(2-piperidin-2-ylethyl)piperazine?
The InChIKey is RZIWSJSUHYEUDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31N3/c1-14(2)13-18-11-9-17(10-12-18)8-6-15-5-3-4-7-16-15/h14-16H,3-13H2,1-2H3.
What are the key properties of 1-(2-methylpropyl)-4-(2-piperidin-2-ylethyl)piperazine?
1-(2-methylpropyl)-4-(2-piperidin-2-ylethyl)piperazine has a molecular weight of 253.43 g/mol, XLogP of 1.79, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methylpropyl)-4-(2-piperidin-2-ylethyl)piperazine is sourced from PubChem (CID 62777599), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).