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

C15H27N3O2 — CID 63848204

IUPAC2-[2-[(cyclopropylamino)methyl]piperidin-1-yl]-1-morpholin-4-ylethanone
SMILESO=C(CN1CCCCC1CNC1CC1)N1CCOCC1
InChIInChI=1S/C15H27N3O2/c19-15(17-7-9-20-10-8-17)12-18-6-2-1-3-14(18)11-16-13-4-5-13/h13-14,16H,1-12H2
InChIKeyXUGJOTJHDZQAOD-UHFFFAOYSA-N
MW281.40 g/mol
LogP0.45
Rot. Bonds5

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

2-[2-[(cyclopropylamino)methyl]piperidin-1-yl]-1-morpholin-4-ylethanone (PubChem CID 63848204) has the molecular formula C15H27N3O2 and a molecular weight of 281.40 g/mol. Its IUPAC name is 2-[2-[(cyclopropylamino)methyl]piperidin-1-yl]-1-morpholin-4-ylethanone.

Molecular Properties

Compound Name2-[2-[(cyclopropylamino)methyl]piperidin-1-yl]-1-morpholin-4-ylethanone
PubChem CID63848204
Molecular FormulaC15H27N3O2
Molecular Weight281.40 g/mol
Exact Mass281.21
IUPAC Name2-[2-[(cyclopropylamino)methyl]piperidin-1-yl]-1-morpholin-4-ylethanone
SMILESO=C(CN1CCCCC1CNC1CC1)N1CCOCC1
InChIInChI=1S/C15H27N3O2/c19-15(17-7-9-20-10-8-17)12-18-6-2-1-3-14(18)11-16-13-4-5-13/h13-14,16H,1-12H2
InChIKeyXUGJOTJHDZQAOD-UHFFFAOYSA-N
XLogP0.45
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 50.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[2-[(cyclopropylamino)methyl]piperidin-1-yl]-1-morpholin-4-ylethanone?
The IUPAC name of 2-[2-[(cyclopropylamino)methyl]piperidin-1-yl]-1-morpholin-4-ylethanone (CID 63848204) is 2-[2-[(cyclopropylamino)methyl]piperidin-1-yl]-1-morpholin-4-ylethanone.
What is the SMILES notation for 2-[2-[(cyclopropylamino)methyl]piperidin-1-yl]-1-morpholin-4-ylethanone?
The canonical SMILES for 2-[2-[(cyclopropylamino)methyl]piperidin-1-yl]-1-morpholin-4-ylethanone is O=C(CN1CCCCC1CNC1CC1)N1CCOCC1.
What is the InChIKey of 2-[2-[(cyclopropylamino)methyl]piperidin-1-yl]-1-morpholin-4-ylethanone?
The InChIKey is XUGJOTJHDZQAOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N3O2/c19-15(17-7-9-20-10-8-17)12-18-6-2-1-3-14(18)11-16-13-4-5-13/h13-14,16H,1-12H2.
What are the key properties of 2-[2-[(cyclopropylamino)methyl]piperidin-1-yl]-1-morpholin-4-ylethanone?
2-[2-[(cyclopropylamino)methyl]piperidin-1-yl]-1-morpholin-4-ylethanone has a molecular weight of 281.40 g/mol, XLogP of 0.45, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[(cyclopropylamino)methyl]piperidin-1-yl]-1-morpholin-4-ylethanone is sourced from PubChem (CID 63848204), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).