(3-aminooxolan-3-yl)-(3-piperidin-1-ylpyrrolidin-1-yl)methanone

C14H25N3O2 — CID 64891813

IUPAC(3-aminooxolan-3-yl)-(3-piperidin-1-ylpyrrolidin-1-yl)methanone
SMILESNC1(C(=O)N2CCC(N3CCCCC3)C2)CCOC1
InChIInChI=1S/C14H25N3O2/c15-14(5-9-19-11-14)13(18)17-8-4-12(10-17)16-6-2-1-3-7-16/h12H,1-11,15H2
InChIKeyYKNWQZKJORJQKR-UHFFFAOYSA-N
MW267.37 g/mol
LogP0.19
Rot. Bonds2

About (3-aminooxolan-3-yl)-(3-piperidin-1-ylpyrrolidin-1-yl)methanone

(3-aminooxolan-3-yl)-(3-piperidin-1-ylpyrrolidin-1-yl)methanone (PubChem CID 64891813) has the molecular formula C14H25N3O2 and a molecular weight of 267.37 g/mol. Its IUPAC name is (3-aminooxolan-3-yl)-(3-piperidin-1-ylpyrrolidin-1-yl)methanone.

Molecular Properties

Compound Name(3-aminooxolan-3-yl)-(3-piperidin-1-ylpyrrolidin-1-yl)methanone
PubChem CID64891813
Molecular FormulaC14H25N3O2
Molecular Weight267.37 g/mol
Exact Mass267.19
IUPAC Name(3-aminooxolan-3-yl)-(3-piperidin-1-ylpyrrolidin-1-yl)methanone
SMILESNC1(C(=O)N2CCC(N3CCCCC3)C2)CCOC1
InChIInChI=1S/C14H25N3O2/c15-14(5-9-19-11-14)13(18)17-8-4-12(10-17)16-6-2-1-3-7-16/h12H,1-11,15H2
InChIKeyYKNWQZKJORJQKR-UHFFFAOYSA-N
XLogP0.19
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 ≤ 50.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (3-aminooxolan-3-yl)-(3-piperidin-1-ylpyrrolidin-1-yl)methanone?
The IUPAC name of (3-aminooxolan-3-yl)-(3-piperidin-1-ylpyrrolidin-1-yl)methanone (CID 64891813) is (3-aminooxolan-3-yl)-(3-piperidin-1-ylpyrrolidin-1-yl)methanone.
What is the SMILES notation for (3-aminooxolan-3-yl)-(3-piperidin-1-ylpyrrolidin-1-yl)methanone?
The canonical SMILES for (3-aminooxolan-3-yl)-(3-piperidin-1-ylpyrrolidin-1-yl)methanone is NC1(C(=O)N2CCC(N3CCCCC3)C2)CCOC1.
What is the InChIKey of (3-aminooxolan-3-yl)-(3-piperidin-1-ylpyrrolidin-1-yl)methanone?
The InChIKey is YKNWQZKJORJQKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3O2/c15-14(5-9-19-11-14)13(18)17-8-4-12(10-17)16-6-2-1-3-7-16/h12H,1-11,15H2.
What are the key properties of (3-aminooxolan-3-yl)-(3-piperidin-1-ylpyrrolidin-1-yl)methanone?
(3-aminooxolan-3-yl)-(3-piperidin-1-ylpyrrolidin-1-yl)methanone has a molecular weight of 267.37 g/mol, XLogP of 0.19, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3-aminooxolan-3-yl)-(3-piperidin-1-ylpyrrolidin-1-yl)methanone is sourced from PubChem (CID 64891813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).