5-methyl-2-(2-methylpropyl)-1-(2-piperidin-1-ylethyl)piperazine

C16H33N3 — CID 82247109

IUPAC5-methyl-2-(2-methylpropyl)-1-(2-piperidin-1-ylethyl)piperazine
SMILESCC(C)CC1CNC(C)CN1CCN1CCCCC1
InChIInChI=1S/C16H33N3/c1-14(2)11-16-12-17-15(3)13-19(16)10-9-18-7-5-4-6-8-18/h14-17H,4-13H2,1-3H3
InChIKeyISXKGDMPWCCBMB-UHFFFAOYSA-N
MW267.46 g/mol
LogP2.18
Rot. Bonds5

About 5-methyl-2-(2-methylpropyl)-1-(2-piperidin-1-ylethyl)piperazine

5-methyl-2-(2-methylpropyl)-1-(2-piperidin-1-ylethyl)piperazine (PubChem CID 82247109) has the molecular formula C16H33N3 and a molecular weight of 267.46 g/mol. Its IUPAC name is 5-methyl-2-(2-methylpropyl)-1-(2-piperidin-1-ylethyl)piperazine.

Molecular Properties

Compound Name5-methyl-2-(2-methylpropyl)-1-(2-piperidin-1-ylethyl)piperazine
PubChem CID82247109
Molecular FormulaC16H33N3
Molecular Weight267.46 g/mol
Exact Mass267.27
IUPAC Name5-methyl-2-(2-methylpropyl)-1-(2-piperidin-1-ylethyl)piperazine
SMILESCC(C)CC1CNC(C)CN1CCN1CCCCC1
InChIInChI=1S/C16H33N3/c1-14(2)11-16-12-17-15(3)13-19(16)10-9-18-7-5-4-6-8-18/h14-17H,4-13H2,1-3H3
InChIKeyISXKGDMPWCCBMB-UHFFFAOYSA-N
XLogP2.18
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.46
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-methyl-1-(2-piperidin-1-ylethyl)-2-propan-2-ylpiperazine
CID 82245206
1-(2-ethylsulfonylethyl)-5-methyl-2-(2-methylpropyl)piperazine
CID 106732837
1-(2-ethoxyethyl)-5-methyl-2-(2-methylpropyl)piperazine
CID 64845397
2-benzyl-5-methyl-1-(2-pyrrolidin-1-ylethyl)piperazine
CID 82250163
5-methyl-2-(2-methylpropyl)-1-(2-pyrazol-1-ylethyl)piperazine
CID 64845781
5-methyl-2-(2-methylpropyl)-1-(3-phenylpropyl)piperazine
CID 64845965
1-(3-chloro-2-methylprop-2-enyl)-5-methyl-2-(2-methylpropyl)piperazine
CID 106440350
1-[(4-bromophenyl)methyl]-5-methyl-2-(2-methylpropyl)piperazine
CID 64845583
3-methyl-1-(2-pyrrolidin-1-ylethyl)piperazine
CID 65448835
1-(2-piperidin-1-ylethyl)-2,5-di(propan-2-yl)piperazine
CID 82249272
1-(3,3-dimethylbutyl)-2,5-bis(2-methylpropyl)piperazine
CID 64848550
4-[2-[2-(2-methylpropyl)piperazin-1-yl]ethyl]morpholine
CID 82245440

Frequently Asked Questions

What is the IUPAC name of 5-methyl-2-(2-methylpropyl)-1-(2-piperidin-1-ylethyl)piperazine?
The IUPAC name of 5-methyl-2-(2-methylpropyl)-1-(2-piperidin-1-ylethyl)piperazine (CID 82247109) is 5-methyl-2-(2-methylpropyl)-1-(2-piperidin-1-ylethyl)piperazine.
What is the SMILES notation for 5-methyl-2-(2-methylpropyl)-1-(2-piperidin-1-ylethyl)piperazine?
The canonical SMILES for 5-methyl-2-(2-methylpropyl)-1-(2-piperidin-1-ylethyl)piperazine is CC(C)CC1CNC(C)CN1CCN1CCCCC1.
What is the InChIKey of 5-methyl-2-(2-methylpropyl)-1-(2-piperidin-1-ylethyl)piperazine?
The InChIKey is ISXKGDMPWCCBMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H33N3/c1-14(2)11-16-12-17-15(3)13-19(16)10-9-18-7-5-4-6-8-18/h14-17H,4-13H2,1-3H3.
What are the key properties of 5-methyl-2-(2-methylpropyl)-1-(2-piperidin-1-ylethyl)piperazine?
5-methyl-2-(2-methylpropyl)-1-(2-piperidin-1-ylethyl)piperazine has a molecular weight of 267.46 g/mol, XLogP of 2.18, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-2-(2-methylpropyl)-1-(2-piperidin-1-ylethyl)piperazine is sourced from PubChem (CID 82247109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).