1-(1,3-dimethylpiperidin-4-yl)-2-ethyl-5-propylpiperazine

C16H33N3 — CID 114506178

IUPAC1-(1,3-dimethylpiperidin-4-yl)-2-ethyl-5-propylpiperazine
SMILESCCCC1CN(C2CCN(C)CC2C)C(CC)CN1
InChIInChI=1S/C16H33N3/c1-5-7-14-12-19(15(6-2)10-17-14)16-8-9-18(4)11-13(16)3/h13-17H,5-12H2,1-4H3
InChIKeyKAZJODRRXWAOPH-UHFFFAOYSA-N
MW267.46 g/mol
LogP2.18
Rot. Bonds4

About 1-(1,3-dimethylpiperidin-4-yl)-2-ethyl-5-propylpiperazine

1-(1,3-dimethylpiperidin-4-yl)-2-ethyl-5-propylpiperazine (PubChem CID 114506178) has the molecular formula C16H33N3 and a molecular weight of 267.46 g/mol. Its IUPAC name is 1-(1,3-dimethylpiperidin-4-yl)-2-ethyl-5-propylpiperazine.

Molecular Properties

Compound Name1-(1,3-dimethylpiperidin-4-yl)-2-ethyl-5-propylpiperazine
PubChem CID114506178
Molecular FormulaC16H33N3
Molecular Weight267.46 g/mol
Exact Mass267.27
IUPAC Name1-(1,3-dimethylpiperidin-4-yl)-2-ethyl-5-propylpiperazine
SMILESCCCC1CN(C2CCN(C)CC2C)C(CC)CN1
InChIInChI=1S/C16H33N3/c1-5-7-14-12-19(15(6-2)10-17-14)16-8-9-18(4)11-13(16)3/h13-17H,5-12H2,1-4H3
InChIKeyKAZJODRRXWAOPH-UHFFFAOYSA-N
XLogP2.18
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
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

1-(1,3-dimethylpiperidin-4-yl)-5-ethyl-2-methylpiperazine
CID 114506139
2,5-diethyl-1-(1-methylpyrrolidin-3-yl)piperazine
CID 64977928
2-ethyl-1-methyl-5-propylpiperazine
CID 64846947
2-ethyl-5-methyl-1-(2-methylcyclobutyl)piperazine
CID 130556507
1-(cyclopentylmethyl)-2-ethyl-5-propylpiperazine
CID 64845195
1-(cyclobutylmethyl)-2-ethyl-5-propylpiperazine
CID 64936155
2-ethyl-5-methyl-1-(1-methylpiperidin-4-yl)piperazine
CID 64937105
2-ethyl-1-(3-ethylpentan-3-yl)-5-propylpiperazine
CID 65043639
1-(1,3-dimethylpiperidin-4-yl)-4-ethyl-6-methyl-1,5-diazocane
CID 114505870
1-(1-cyclohexylpropyl)-2-ethyl-5-propylpiperazine
CID 64940753
1-(2-ethoxyethyl)-2-ethyl-5-propylpiperazine
CID 64846765
1-(2,3-dimethylcyclopentyl)-2-ethyl-5-methylpiperazine
CID 64938031

Frequently Asked Questions

What is the IUPAC name of 1-(1,3-dimethylpiperidin-4-yl)-2-ethyl-5-propylpiperazine?
The IUPAC name of 1-(1,3-dimethylpiperidin-4-yl)-2-ethyl-5-propylpiperazine (CID 114506178) is 1-(1,3-dimethylpiperidin-4-yl)-2-ethyl-5-propylpiperazine.
What is the SMILES notation for 1-(1,3-dimethylpiperidin-4-yl)-2-ethyl-5-propylpiperazine?
The canonical SMILES for 1-(1,3-dimethylpiperidin-4-yl)-2-ethyl-5-propylpiperazine is CCCC1CN(C2CCN(C)CC2C)C(CC)CN1.
What is the InChIKey of 1-(1,3-dimethylpiperidin-4-yl)-2-ethyl-5-propylpiperazine?
The InChIKey is KAZJODRRXWAOPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H33N3/c1-5-7-14-12-19(15(6-2)10-17-14)16-8-9-18(4)11-13(16)3/h13-17H,5-12H2,1-4H3.
What are the key properties of 1-(1,3-dimethylpiperidin-4-yl)-2-ethyl-5-propylpiperazine?
1-(1,3-dimethylpiperidin-4-yl)-2-ethyl-5-propylpiperazine has a molecular weight of 267.46 g/mol, XLogP of 2.18, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1,3-dimethylpiperidin-4-yl)-2-ethyl-5-propylpiperazine is sourced from PubChem (CID 114506178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).