4-(1-propan-2-ylpiperidin-4-yl)morpholin-3-one

C12H22N2O2 — CID 22980209

IUPAC4-(1-propan-2-ylpiperidin-4-yl)morpholin-3-one
SMILESCC(C)N1CCC(N2CCOCC2=O)CC1
InChIInChI=1S/C12H22N2O2/c1-10(2)13-5-3-11(4-6-13)14-7-8-16-9-12(14)15/h10-11H,3-9H2,1-2H3
InChIKeyRUCGIANSOXCQAD-UHFFFAOYSA-N
MW226.32 g/mol
LogP0.72
Rot. Bonds2

About 4-(1-propan-2-ylpiperidin-4-yl)morpholin-3-one

4-(1-propan-2-ylpiperidin-4-yl)morpholin-3-one (PubChem CID 22980209) has the molecular formula C12H22N2O2 and a molecular weight of 226.32 g/mol. Its IUPAC name is 4-(1-propan-2-ylpiperidin-4-yl)morpholin-3-one.

Molecular Properties

Compound Name4-(1-propan-2-ylpiperidin-4-yl)morpholin-3-one
PubChem CID22980209
Molecular FormulaC12H22N2O2
Molecular Weight226.32 g/mol
Exact Mass226.17
IUPAC Name4-(1-propan-2-ylpiperidin-4-yl)morpholin-3-one
SMILESCC(C)N1CCC(N2CCOCC2=O)CC1
InChIInChI=1S/C12H22N2O2/c1-10(2)13-5-3-11(4-6-13)14-7-8-16-9-12(14)15/h10-11H,3-9H2,1-2H3
InChIKeyRUCGIANSOXCQAD-UHFFFAOYSA-N
XLogP0.72
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.32
LogP ≤ 50.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(1-propan-2-ylpiperidin-4-yl)morpholin-3-one?
The IUPAC name of 4-(1-propan-2-ylpiperidin-4-yl)morpholin-3-one (CID 22980209) is 4-(1-propan-2-ylpiperidin-4-yl)morpholin-3-one.
What is the SMILES notation for 4-(1-propan-2-ylpiperidin-4-yl)morpholin-3-one?
The canonical SMILES for 4-(1-propan-2-ylpiperidin-4-yl)morpholin-3-one is CC(C)N1CCC(N2CCOCC2=O)CC1.
What is the InChIKey of 4-(1-propan-2-ylpiperidin-4-yl)morpholin-3-one?
The InChIKey is RUCGIANSOXCQAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O2/c1-10(2)13-5-3-11(4-6-13)14-7-8-16-9-12(14)15/h10-11H,3-9H2,1-2H3.
What are the key properties of 4-(1-propan-2-ylpiperidin-4-yl)morpholin-3-one?
4-(1-propan-2-ylpiperidin-4-yl)morpholin-3-one has a molecular weight of 226.32 g/mol, XLogP of 0.72, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-propan-2-ylpiperidin-4-yl)morpholin-3-one is sourced from PubChem (CID 22980209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).