1-(2-methylmorpholin-4-yl)-2-piperidin-4-ylethanone

C12H22N2O2 — CID 24701472

IUPAC1-(2-methylmorpholin-4-yl)-2-piperidin-4-ylethanone
SMILESCC1CN(C(=O)CC2CCNCC2)CCO1
InChIInChI=1S/C12H22N2O2/c1-10-9-14(6-7-16-10)12(15)8-11-2-4-13-5-3-11/h10-11,13H,2-9H2,1H3
InChIKeyRXXBVIUJKBZJPN-UHFFFAOYSA-N
MW226.32 g/mol
LogP0.62
Rot. Bonds2

About 1-(2-methylmorpholin-4-yl)-2-piperidin-4-ylethanone

1-(2-methylmorpholin-4-yl)-2-piperidin-4-ylethanone (PubChem CID 24701472) has the molecular formula C12H22N2O2 and a molecular weight of 226.32 g/mol. Its IUPAC name is 1-(2-methylmorpholin-4-yl)-2-piperidin-4-ylethanone.

Molecular Properties

Compound Name1-(2-methylmorpholin-4-yl)-2-piperidin-4-ylethanone
PubChem CID24701472
Molecular FormulaC12H22N2O2
Molecular Weight226.32 g/mol
Exact Mass226.17
IUPAC Name1-(2-methylmorpholin-4-yl)-2-piperidin-4-ylethanone
SMILESCC1CN(C(=O)CC2CCNCC2)CCO1
InChIInChI=1S/C12H22N2O2/c1-10-9-14(6-7-16-10)12(15)8-11-2-4-13-5-3-11/h10-11,13H,2-9H2,1H3
InChIKeyRXXBVIUJKBZJPN-UHFFFAOYSA-N
XLogP0.62
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.32
LogP ≤ 50.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(2-methylmorpholin-4-yl)-2-piperidin-4-ylethanone?
The IUPAC name of 1-(2-methylmorpholin-4-yl)-2-piperidin-4-ylethanone (CID 24701472) is 1-(2-methylmorpholin-4-yl)-2-piperidin-4-ylethanone.
What is the SMILES notation for 1-(2-methylmorpholin-4-yl)-2-piperidin-4-ylethanone?
The canonical SMILES for 1-(2-methylmorpholin-4-yl)-2-piperidin-4-ylethanone is CC1CN(C(=O)CC2CCNCC2)CCO1.
What is the InChIKey of 1-(2-methylmorpholin-4-yl)-2-piperidin-4-ylethanone?
The InChIKey is RXXBVIUJKBZJPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O2/c1-10-9-14(6-7-16-10)12(15)8-11-2-4-13-5-3-11/h10-11,13H,2-9H2,1H3.
What are the key properties of 1-(2-methylmorpholin-4-yl)-2-piperidin-4-ylethanone?
1-(2-methylmorpholin-4-yl)-2-piperidin-4-ylethanone has a molecular weight of 226.32 g/mol, XLogP of 0.62, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methylmorpholin-4-yl)-2-piperidin-4-ylethanone is sourced from PubChem (CID 24701472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).