1-ethyl-4-[2-(1-propan-2-ylpiperidin-4-yl)oxyethyl]piperazine

C16H33N3O — CID 155702560

IUPAC1-ethyl-4-[2-(1-propan-2-ylpiperidin-4-yl)oxyethyl]piperazine
SMILESCCN1CCN(CCOC2CCN(C(C)C)CC2)CC1
InChIInChI=1S/C16H33N3O/c1-4-17-9-11-18(12-10-17)13-14-20-16-5-7-19(8-6-16)15(2)3/h15-16H,4-14H2,1-3H3
InChIKeyUGSDDQVVACGBRP-UHFFFAOYSA-N
MW283.46 g/mol
LogP1.51
Rot. Bonds6

About 1-ethyl-4-[2-(1-propan-2-ylpiperidin-4-yl)oxyethyl]piperazine

1-ethyl-4-[2-(1-propan-2-ylpiperidin-4-yl)oxyethyl]piperazine (PubChem CID 155702560) has the molecular formula C16H33N3O and a molecular weight of 283.46 g/mol. Its IUPAC name is 1-ethyl-4-[2-(1-propan-2-ylpiperidin-4-yl)oxyethyl]piperazine.

Molecular Properties

Compound Name1-ethyl-4-[2-(1-propan-2-ylpiperidin-4-yl)oxyethyl]piperazine
PubChem CID155702560
Molecular FormulaC16H33N3O
Molecular Weight283.46 g/mol
Exact Mass283.26
IUPAC Name1-ethyl-4-[2-(1-propan-2-ylpiperidin-4-yl)oxyethyl]piperazine
SMILESCCN1CCN(CCOC2CCN(C(C)C)CC2)CC1
InChIInChI=1S/C16H33N3O/c1-4-17-9-11-18(12-10-17)13-14-20-16-5-7-19(8-6-16)15(2)3/h15-16H,4-14H2,1-3H3
InChIKeyUGSDDQVVACGBRP-UHFFFAOYSA-N
XLogP1.51
TPSA18.95 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.46
LogP ≤ 51.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1-ethyl-4-[2-(1-methylpiperidin-4-yl)oxyethyl]piperazine
CID 156884985
1-(2-cyclobutyloxyethyl)-4-ethylpiperazine
CID 142616194
1-propan-2-yl-4-[2-[2-[2-[2-[2-(2-propoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]piperidine
CID 174243308
ethane;1-ethyl-4-[2-(1-propylpiperidin-4-yl)oxyethyl]piperazine;1-[2-(1-propylpiperidin-4-yl)oxyethyl]piperazine
CID 156885090
1-(2-cyclobutyloxyethyl)-4-(2-methylbutyl)piperazine
CID 156794849
acetamide;1-(2-cyclobutyloxyethyl)-4-ethylpiperazine;molecular hydrogen
CID 142616193
4-(4-ethylcyclohexyl)oxy-1-propan-2-ylpiperidine;1-[2-(3-methylbutoxy)ethyl]-4-propan-2-ylpiperazine
CID 176986204
4-ethoxy-1-[(1-propan-2-ylpiperidin-4-yl)methyl]piperidine
CID 171070473
1-ethyl-N-(1-propan-2-ylpiperidin-4-yl)piperidin-4-amine
CID 28716489
(2S)-N-pentan-3-yl-2-[4-(2-pyrrolidin-1-ylethoxy)piperidin-1-yl]propanamide
CID 95784085
ethane;N-[2-[4-[(4-ethylpiperazin-1-yl)methyl]piperidin-1-yl]ethyl]-N-methylpropan-2-amine;1-(2-propan-2-yloxyethyl)-4-[(1-propan-2-ylpiperidin-4-yl)methyl]piperazine
CID 177203726
ethane;1-ethyl-4-[2-(4-ethylcyclohexyl)ethoxy]piperidine;1-fluoro-4-[2-(4-methylpiperidin-1-yl)ethoxy]piperidine
CID 176985163

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-4-[2-(1-propan-2-ylpiperidin-4-yl)oxyethyl]piperazine?
The IUPAC name of 1-ethyl-4-[2-(1-propan-2-ylpiperidin-4-yl)oxyethyl]piperazine (CID 155702560) is 1-ethyl-4-[2-(1-propan-2-ylpiperidin-4-yl)oxyethyl]piperazine.
What is the SMILES notation for 1-ethyl-4-[2-(1-propan-2-ylpiperidin-4-yl)oxyethyl]piperazine?
The canonical SMILES for 1-ethyl-4-[2-(1-propan-2-ylpiperidin-4-yl)oxyethyl]piperazine is CCN1CCN(CCOC2CCN(C(C)C)CC2)CC1.
What is the InChIKey of 1-ethyl-4-[2-(1-propan-2-ylpiperidin-4-yl)oxyethyl]piperazine?
The InChIKey is UGSDDQVVACGBRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H33N3O/c1-4-17-9-11-18(12-10-17)13-14-20-16-5-7-19(8-6-16)15(2)3/h15-16H,4-14H2,1-3H3.
What are the key properties of 1-ethyl-4-[2-(1-propan-2-ylpiperidin-4-yl)oxyethyl]piperazine?
1-ethyl-4-[2-(1-propan-2-ylpiperidin-4-yl)oxyethyl]piperazine has a molecular weight of 283.46 g/mol, XLogP of 1.51, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-4-[2-(1-propan-2-ylpiperidin-4-yl)oxyethyl]piperazine is sourced from PubChem (CID 155702560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).