(4-aminooxolan-3-yl)-(4-pyrrolidin-1-ylpiperidin-1-yl)methanone

C14H25N3O2 — CID 66235844

IUPAC(4-aminooxolan-3-yl)-(4-pyrrolidin-1-ylpiperidin-1-yl)methanone
SMILESNC1COCC1C(=O)N1CCC(N2CCCC2)CC1
InChIInChI=1S/C14H25N3O2/c15-13-10-19-9-12(13)14(18)17-7-3-11(4-8-17)16-5-1-2-6-16/h11-13H,1-10,15H2
InChIKeyIZPSJJABEKCUQL-UHFFFAOYSA-N
MW267.37 g/mol
LogP0.05
Rot. Bonds2

About (4-aminooxolan-3-yl)-(4-pyrrolidin-1-ylpiperidin-1-yl)methanone

(4-aminooxolan-3-yl)-(4-pyrrolidin-1-ylpiperidin-1-yl)methanone (PubChem CID 66235844) has the molecular formula C14H25N3O2 and a molecular weight of 267.37 g/mol. Its IUPAC name is (4-aminooxolan-3-yl)-(4-pyrrolidin-1-ylpiperidin-1-yl)methanone.

Molecular Properties

Compound Name(4-aminooxolan-3-yl)-(4-pyrrolidin-1-ylpiperidin-1-yl)methanone
PubChem CID66235844
Molecular FormulaC14H25N3O2
Molecular Weight267.37 g/mol
Exact Mass267.19
IUPAC Name(4-aminooxolan-3-yl)-(4-pyrrolidin-1-ylpiperidin-1-yl)methanone
SMILESNC1COCC1C(=O)N1CCC(N2CCCC2)CC1
InChIInChI=1S/C14H25N3O2/c15-13-10-19-9-12(13)14(18)17-7-3-11(4-8-17)16-5-1-2-6-16/h11-13H,1-10,15H2
InChIKeyIZPSJJABEKCUQL-UHFFFAOYSA-N
XLogP0.05
TPSA58.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.37
LogP ≤ 50.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (4-aminooxolan-3-yl)-(4-pyrrolidin-1-ylpiperidin-1-yl)methanone?
The IUPAC name of (4-aminooxolan-3-yl)-(4-pyrrolidin-1-ylpiperidin-1-yl)methanone (CID 66235844) is (4-aminooxolan-3-yl)-(4-pyrrolidin-1-ylpiperidin-1-yl)methanone.
What is the SMILES notation for (4-aminooxolan-3-yl)-(4-pyrrolidin-1-ylpiperidin-1-yl)methanone?
The canonical SMILES for (4-aminooxolan-3-yl)-(4-pyrrolidin-1-ylpiperidin-1-yl)methanone is NC1COCC1C(=O)N1CCC(N2CCCC2)CC1.
What is the InChIKey of (4-aminooxolan-3-yl)-(4-pyrrolidin-1-ylpiperidin-1-yl)methanone?
The InChIKey is IZPSJJABEKCUQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3O2/c15-13-10-19-9-12(13)14(18)17-7-3-11(4-8-17)16-5-1-2-6-16/h11-13H,1-10,15H2.
What are the key properties of (4-aminooxolan-3-yl)-(4-pyrrolidin-1-ylpiperidin-1-yl)methanone?
(4-aminooxolan-3-yl)-(4-pyrrolidin-1-ylpiperidin-1-yl)methanone has a molecular weight of 267.37 g/mol, XLogP of 0.05, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4-aminooxolan-3-yl)-(4-pyrrolidin-1-ylpiperidin-1-yl)methanone is sourced from PubChem (CID 66235844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).