oxan-3-yl-(3-pyrrolidin-2-ylpiperidin-1-yl)methanone

C15H26N2O2 — CID 62759011

IUPACoxan-3-yl-(3-pyrrolidin-2-ylpiperidin-1-yl)methanone
SMILESO=C(C1CCCOC1)N1CCCC(C2CCCN2)C1
InChIInChI=1S/C15H26N2O2/c18-15(13-5-3-9-19-11-13)17-8-2-4-12(10-17)14-6-1-7-16-14/h12-14,16H,1-11H2
InChIKeyXAYRPYFZWYEXQG-UHFFFAOYSA-N
MW266.38 g/mol
LogP1.40
Rot. Bonds2

About oxan-3-yl-(3-pyrrolidin-2-ylpiperidin-1-yl)methanone

oxan-3-yl-(3-pyrrolidin-2-ylpiperidin-1-yl)methanone (PubChem CID 62759011) has the molecular formula C15H26N2O2 and a molecular weight of 266.38 g/mol. Its IUPAC name is oxan-3-yl-(3-pyrrolidin-2-ylpiperidin-1-yl)methanone.

Molecular Properties

Compound Nameoxan-3-yl-(3-pyrrolidin-2-ylpiperidin-1-yl)methanone
PubChem CID62759011
Molecular FormulaC15H26N2O2
Molecular Weight266.38 g/mol
Exact Mass266.20
IUPAC Nameoxan-3-yl-(3-pyrrolidin-2-ylpiperidin-1-yl)methanone
SMILESO=C(C1CCCOC1)N1CCCC(C2CCCN2)C1
InChIInChI=1S/C15H26N2O2/c18-15(13-5-3-9-19-11-13)17-8-2-4-12(10-17)14-6-1-7-16-14/h12-14,16H,1-11H2
InChIKeyXAYRPYFZWYEXQG-UHFFFAOYSA-N
XLogP1.40
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.38
LogP ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze oxan-3-yl-(3-pyrrolidin-2-ylpiperidin-1-yl)methanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of oxan-3-yl-(3-pyrrolidin-2-ylpiperidin-1-yl)methanone?
The IUPAC name of oxan-3-yl-(3-pyrrolidin-2-ylpiperidin-1-yl)methanone (CID 62759011) is oxan-3-yl-(3-pyrrolidin-2-ylpiperidin-1-yl)methanone.
What is the SMILES notation for oxan-3-yl-(3-pyrrolidin-2-ylpiperidin-1-yl)methanone?
The canonical SMILES for oxan-3-yl-(3-pyrrolidin-2-ylpiperidin-1-yl)methanone is O=C(C1CCCOC1)N1CCCC(C2CCCN2)C1.
What is the InChIKey of oxan-3-yl-(3-pyrrolidin-2-ylpiperidin-1-yl)methanone?
The InChIKey is XAYRPYFZWYEXQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O2/c18-15(13-5-3-9-19-11-13)17-8-2-4-12(10-17)14-6-1-7-16-14/h12-14,16H,1-11H2.
What are the key properties of oxan-3-yl-(3-pyrrolidin-2-ylpiperidin-1-yl)methanone?
oxan-3-yl-(3-pyrrolidin-2-ylpiperidin-1-yl)methanone has a molecular weight of 266.38 g/mol, XLogP of 1.40, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for oxan-3-yl-(3-pyrrolidin-2-ylpiperidin-1-yl)methanone is sourced from PubChem (CID 62759011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).