1-ethyl-3-pyrrolidin-3-yloxypiperidine

C11H22N2O — CID 112547534

IUPAC1-ethyl-3-pyrrolidin-3-yloxypiperidine
SMILESCCN1CCCC(OC2CCNC2)C1
InChIInChI=1S/C11H22N2O/c1-2-13-7-3-4-11(9-13)14-10-5-6-12-8-10/h10-12H,2-9H2,1H3
InChIKeyHGPFABWOKQKAES-UHFFFAOYSA-N
MW198.31 g/mol
LogP0.85
Rot. Bonds3

About 1-ethyl-3-pyrrolidin-3-yloxypiperidine

1-ethyl-3-pyrrolidin-3-yloxypiperidine (PubChem CID 112547534) has the molecular formula C11H22N2O and a molecular weight of 198.31 g/mol. Its IUPAC name is 1-ethyl-3-pyrrolidin-3-yloxypiperidine.

Molecular Properties

Compound Name1-ethyl-3-pyrrolidin-3-yloxypiperidine
PubChem CID112547534
Molecular FormulaC11H22N2O
Molecular Weight198.31 g/mol
Exact Mass198.17
IUPAC Name1-ethyl-3-pyrrolidin-3-yloxypiperidine
SMILESCCN1CCCC(OC2CCNC2)C1
InChIInChI=1S/C11H22N2O/c1-2-13-7-3-4-11(9-13)14-10-5-6-12-8-10/h10-12H,2-9H2,1H3
InChIKeyHGPFABWOKQKAES-UHFFFAOYSA-N
XLogP0.85
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 50.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-propan-2-yl-3-pyrrolidin-3-yloxypiperidine
CID 117046264
3-ethoxy-1-(pyrrolidin-3-ylmethyl)piperidine
CID 62370527
(3S)-1-methyl-3-piperidin-4-yloxypiperidine
CID 97181123
3-(difluoromethoxy)-1-ethylpiperidine
CID 130226338
(3R)-3-[(3R)-piperidin-3-yl]oxypiperidine
CID 142756272
1-[(1-ethylpyrrolidin-3-yl)methyl]-4-[(4-piperidin-4-yloxycyclohexyl)methyl]piperazine
CID 171641363
3-(azetidin-3-yloxy)pyrrolidine;dihydrochloride
CID 155893811
[4-[(1-ethylpiperidin-3-yl)methyl]piperazin-1-yl]-(4-piperidin-4-yloxycyclohexyl)methanone
CID 171641865
1-(1-ethylpiperidin-3-yl)piperazine
CID 52992040
4-cyclobutyloxy-1-ethylpiperidine;ethane
CID 176982865
(1-ethylpiperidin-3-yl) N,N-dimethylcarbamate
CID 45091641
N-[(1-ethylpyrrolidin-3-yl)methyl]pyrrolidin-3-amine
CID 79731365

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-3-pyrrolidin-3-yloxypiperidine?
The IUPAC name of 1-ethyl-3-pyrrolidin-3-yloxypiperidine (CID 112547534) is 1-ethyl-3-pyrrolidin-3-yloxypiperidine.
What is the SMILES notation for 1-ethyl-3-pyrrolidin-3-yloxypiperidine?
The canonical SMILES for 1-ethyl-3-pyrrolidin-3-yloxypiperidine is CCN1CCCC(OC2CCNC2)C1.
What is the InChIKey of 1-ethyl-3-pyrrolidin-3-yloxypiperidine?
The InChIKey is HGPFABWOKQKAES-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O/c1-2-13-7-3-4-11(9-13)14-10-5-6-12-8-10/h10-12H,2-9H2,1H3.
What are the key properties of 1-ethyl-3-pyrrolidin-3-yloxypiperidine?
1-ethyl-3-pyrrolidin-3-yloxypiperidine has a molecular weight of 198.31 g/mol, XLogP of 0.85, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-3-pyrrolidin-3-yloxypiperidine is sourced from PubChem (CID 112547534), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).