3-piperidin-4-yl-1,3-oxazinan-2-one

C9H16N2O2 — CID 22137522

IUPAC3-piperidin-4-yl-1,3-oxazinan-2-one
SMILESO=C1OCCCN1C1CCNCC1
InChIInChI=1S/C9H16N2O2/c12-9-11(6-1-7-13-9)8-2-4-10-5-3-8/h8,10H,1-7H2
InChIKeyUAMPFCXIVPCTCN-UHFFFAOYSA-N
MW184.24 g/mol
LogP0.58
Rot. Bonds1

About 3-piperidin-4-yl-1,3-oxazinan-2-one

3-piperidin-4-yl-1,3-oxazinan-2-one (PubChem CID 22137522) has the molecular formula C9H16N2O2 and a molecular weight of 184.24 g/mol. Its IUPAC name is 3-piperidin-4-yl-1,3-oxazinan-2-one.

Molecular Properties

Compound Name3-piperidin-4-yl-1,3-oxazinan-2-one
PubChem CID22137522
Molecular FormulaC9H16N2O2
Molecular Weight184.24 g/mol
Exact Mass184.12
IUPAC Name3-piperidin-4-yl-1,3-oxazinan-2-one
SMILESO=C1OCCCN1C1CCNCC1
InChIInChI=1S/C9H16N2O2/c12-9-11(6-1-7-13-9)8-2-4-10-5-3-8/h8,10H,1-7H2
InChIKeyUAMPFCXIVPCTCN-UHFFFAOYSA-N
XLogP0.58
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.24
LogP ≤ 50.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-piperidin-4-yl-1,3-oxazinan-2-one?
The IUPAC name of 3-piperidin-4-yl-1,3-oxazinan-2-one (CID 22137522) is 3-piperidin-4-yl-1,3-oxazinan-2-one.
What is the SMILES notation for 3-piperidin-4-yl-1,3-oxazinan-2-one?
The canonical SMILES for 3-piperidin-4-yl-1,3-oxazinan-2-one is O=C1OCCCN1C1CCNCC1.
What is the InChIKey of 3-piperidin-4-yl-1,3-oxazinan-2-one?
The InChIKey is UAMPFCXIVPCTCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2O2/c12-9-11(6-1-7-13-9)8-2-4-10-5-3-8/h8,10H,1-7H2.
What are the key properties of 3-piperidin-4-yl-1,3-oxazinan-2-one?
3-piperidin-4-yl-1,3-oxazinan-2-one has a molecular weight of 184.24 g/mol, XLogP of 0.58, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-piperidin-4-yl-1,3-oxazinan-2-one is sourced from PubChem (CID 22137522), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).