(1-ethylpiperidin-3-yl)-pyrrolidin-1-ylmethanone

C12H22N2O — CID 71121535

IUPAC(1-ethylpiperidin-3-yl)-pyrrolidin-1-ylmethanone
SMILESCCN1CCCC(C(=O)N2CCCC2)C1
InChIInChI=1S/C12H22N2O/c1-2-13-7-5-6-11(10-13)12(15)14-8-3-4-9-14/h11H,2-10H2,1H3
InChIKeySJEYTFQYHFLLOF-UHFFFAOYSA-N
MW210.32 g/mol
LogP1.34
Rot. Bonds2

About (1-ethylpiperidin-3-yl)-pyrrolidin-1-ylmethanone

(1-ethylpiperidin-3-yl)-pyrrolidin-1-ylmethanone (PubChem CID 71121535) has the molecular formula C12H22N2O and a molecular weight of 210.32 g/mol. Its IUPAC name is (1-ethylpiperidin-3-yl)-pyrrolidin-1-ylmethanone.

Molecular Properties

Compound Name(1-ethylpiperidin-3-yl)-pyrrolidin-1-ylmethanone
PubChem CID71121535
Molecular FormulaC12H22N2O
Molecular Weight210.32 g/mol
Exact Mass210.17
IUPAC Name(1-ethylpiperidin-3-yl)-pyrrolidin-1-ylmethanone
SMILESCCN1CCCC(C(=O)N2CCCC2)C1
InChIInChI=1S/C12H22N2O/c1-2-13-7-5-6-11(10-13)12(15)14-8-3-4-9-14/h11H,2-10H2,1H3
InChIKeySJEYTFQYHFLLOF-UHFFFAOYSA-N
XLogP1.34
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.32
LogP ≤ 51.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (1-ethylpiperidin-3-yl)-pyrrolidin-1-ylmethanone?
The IUPAC name of (1-ethylpiperidin-3-yl)-pyrrolidin-1-ylmethanone (CID 71121535) is (1-ethylpiperidin-3-yl)-pyrrolidin-1-ylmethanone.
What is the SMILES notation for (1-ethylpiperidin-3-yl)-pyrrolidin-1-ylmethanone?
The canonical SMILES for (1-ethylpiperidin-3-yl)-pyrrolidin-1-ylmethanone is CCN1CCCC(C(=O)N2CCCC2)C1.
What is the InChIKey of (1-ethylpiperidin-3-yl)-pyrrolidin-1-ylmethanone?
The InChIKey is SJEYTFQYHFLLOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O/c1-2-13-7-5-6-11(10-13)12(15)14-8-3-4-9-14/h11H,2-10H2,1H3.
What are the key properties of (1-ethylpiperidin-3-yl)-pyrrolidin-1-ylmethanone?
(1-ethylpiperidin-3-yl)-pyrrolidin-1-ylmethanone has a molecular weight of 210.32 g/mol, XLogP of 1.34, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1-ethylpiperidin-3-yl)-pyrrolidin-1-ylmethanone is sourced from PubChem (CID 71121535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).