2-[4-(methylamino)piperidin-1-yl]-1-morpholin-4-ylethanone

C12H23N3O2 — CID 60818068

IUPAC2-[4-(methylamino)piperidin-1-yl]-1-morpholin-4-ylethanone
SMILESCNC1CCN(CC(=O)N2CCOCC2)CC1
InChIInChI=1S/C12H23N3O2/c1-13-11-2-4-14(5-3-11)10-12(16)15-6-8-17-9-7-15/h11,13H,2-10H2,1H3
InChIKeyBHDAJQPKAHBNJL-UHFFFAOYSA-N
MW241.33 g/mol
LogP-0.47
Rot. Bonds3

About 2-[4-(methylamino)piperidin-1-yl]-1-morpholin-4-ylethanone

2-[4-(methylamino)piperidin-1-yl]-1-morpholin-4-ylethanone (PubChem CID 60818068) has the molecular formula C12H23N3O2 and a molecular weight of 241.33 g/mol. Its IUPAC name is 2-[4-(methylamino)piperidin-1-yl]-1-morpholin-4-ylethanone.

Molecular Properties

Compound Name2-[4-(methylamino)piperidin-1-yl]-1-morpholin-4-ylethanone
PubChem CID60818068
Molecular FormulaC12H23N3O2
Molecular Weight241.33 g/mol
Exact Mass241.18
IUPAC Name2-[4-(methylamino)piperidin-1-yl]-1-morpholin-4-ylethanone
SMILESCNC1CCN(CC(=O)N2CCOCC2)CC1
InChIInChI=1S/C12H23N3O2/c1-13-11-2-4-14(5-3-11)10-12(16)15-6-8-17-9-7-15/h11,13H,2-10H2,1H3
InChIKeyBHDAJQPKAHBNJL-UHFFFAOYSA-N
XLogP-0.47
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.33
LogP ≤ 5-0.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[4-(methylamino)piperidin-1-yl]-1-morpholin-4-ylethanone?
The IUPAC name of 2-[4-(methylamino)piperidin-1-yl]-1-morpholin-4-ylethanone (CID 60818068) is 2-[4-(methylamino)piperidin-1-yl]-1-morpholin-4-ylethanone.
What is the SMILES notation for 2-[4-(methylamino)piperidin-1-yl]-1-morpholin-4-ylethanone?
The canonical SMILES for 2-[4-(methylamino)piperidin-1-yl]-1-morpholin-4-ylethanone is CNC1CCN(CC(=O)N2CCOCC2)CC1.
What is the InChIKey of 2-[4-(methylamino)piperidin-1-yl]-1-morpholin-4-ylethanone?
The InChIKey is BHDAJQPKAHBNJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3O2/c1-13-11-2-4-14(5-3-11)10-12(16)15-6-8-17-9-7-15/h11,13H,2-10H2,1H3.
What are the key properties of 2-[4-(methylamino)piperidin-1-yl]-1-morpholin-4-ylethanone?
2-[4-(methylamino)piperidin-1-yl]-1-morpholin-4-ylethanone has a molecular weight of 241.33 g/mol, XLogP of -0.47, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(methylamino)piperidin-1-yl]-1-morpholin-4-ylethanone is sourced from PubChem (CID 60818068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).