1-(2-ethylcyclohexyl)-2-pyrrolidin-2-ylpiperidine

C17H32N2 — CID 63863432

IUPAC1-(2-ethylcyclohexyl)-2-pyrrolidin-2-ylpiperidine
SMILESCCC1CCCCC1N1CCCCC1C1CCCN1
InChIInChI=1S/C17H32N2/c1-2-14-8-3-4-10-16(14)19-13-6-5-11-17(19)15-9-7-12-18-15/h14-18H,2-13H2,1H3
InChIKeyQHADXZNGYFDADF-UHFFFAOYSA-N
MW264.46 g/mol
LogP3.56
Rot. Bonds3

About 1-(2-ethylcyclohexyl)-2-pyrrolidin-2-ylpiperidine

1-(2-ethylcyclohexyl)-2-pyrrolidin-2-ylpiperidine (PubChem CID 63863432) has the molecular formula C17H32N2 and a molecular weight of 264.46 g/mol. Its IUPAC name is 1-(2-ethylcyclohexyl)-2-pyrrolidin-2-ylpiperidine.

Molecular Properties

Compound Name1-(2-ethylcyclohexyl)-2-pyrrolidin-2-ylpiperidine
PubChem CID63863432
Molecular FormulaC17H32N2
Molecular Weight264.46 g/mol
Exact Mass264.26
IUPAC Name1-(2-ethylcyclohexyl)-2-pyrrolidin-2-ylpiperidine
SMILESCCC1CCCCC1N1CCCCC1C1CCCN1
InChIInChI=1S/C17H32N2/c1-2-14-8-3-4-10-16(14)19-13-6-5-11-17(19)15-9-7-12-18-15/h14-18H,2-13H2,1H3
InChIKeyQHADXZNGYFDADF-UHFFFAOYSA-N
XLogP3.56
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.46
LogP ≤ 53.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(2-ethylcyclohexyl)-2-pyrrolidin-2-ylpiperidine?
The IUPAC name of 1-(2-ethylcyclohexyl)-2-pyrrolidin-2-ylpiperidine (CID 63863432) is 1-(2-ethylcyclohexyl)-2-pyrrolidin-2-ylpiperidine.
What is the SMILES notation for 1-(2-ethylcyclohexyl)-2-pyrrolidin-2-ylpiperidine?
The canonical SMILES for 1-(2-ethylcyclohexyl)-2-pyrrolidin-2-ylpiperidine is CCC1CCCCC1N1CCCCC1C1CCCN1.
What is the InChIKey of 1-(2-ethylcyclohexyl)-2-pyrrolidin-2-ylpiperidine?
The InChIKey is QHADXZNGYFDADF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H32N2/c1-2-14-8-3-4-10-16(14)19-13-6-5-11-17(19)15-9-7-12-18-15/h14-18H,2-13H2,1H3.
What are the key properties of 1-(2-ethylcyclohexyl)-2-pyrrolidin-2-ylpiperidine?
1-(2-ethylcyclohexyl)-2-pyrrolidin-2-ylpiperidine has a molecular weight of 264.46 g/mol, XLogP of 3.56, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-ethylcyclohexyl)-2-pyrrolidin-2-ylpiperidine is sourced from PubChem (CID 63863432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).