1-(cyclopropylmethyl)-3-morpholin-4-ylpiperidin-2-one

C13H22N2O2 — CID 71687081

IUPAC1-(cyclopropylmethyl)-3-morpholin-4-ylpiperidin-2-one
SMILESO=C1C(N2CCOCC2)CCCN1CC1CC1
InChIInChI=1S/C13H22N2O2/c16-13-12(14-6-8-17-9-7-14)2-1-5-15(13)10-11-3-4-11/h11-12H,1-10H2
InChIKeyUNMFDWQHUHXJJF-UHFFFAOYSA-N
MW238.33 g/mol
LogP0.72
Rot. Bonds3

About 1-(cyclopropylmethyl)-3-morpholin-4-ylpiperidin-2-one

1-(cyclopropylmethyl)-3-morpholin-4-ylpiperidin-2-one (PubChem CID 71687081) has the molecular formula C13H22N2O2 and a molecular weight of 238.33 g/mol. Its IUPAC name is 1-(cyclopropylmethyl)-3-morpholin-4-ylpiperidin-2-one.

Molecular Properties

Compound Name1-(cyclopropylmethyl)-3-morpholin-4-ylpiperidin-2-one
PubChem CID71687081
Molecular FormulaC13H22N2O2
Molecular Weight238.33 g/mol
Exact Mass238.17
IUPAC Name1-(cyclopropylmethyl)-3-morpholin-4-ylpiperidin-2-one
SMILESO=C1C(N2CCOCC2)CCCN1CC1CC1
InChIInChI=1S/C13H22N2O2/c16-13-12(14-6-8-17-9-7-14)2-1-5-15(13)10-11-3-4-11/h11-12H,1-10H2
InChIKeyUNMFDWQHUHXJJF-UHFFFAOYSA-N
XLogP0.72
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.33
LogP ≤ 50.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(cyclopropylmethyl)-3-morpholin-4-ylpiperidin-2-one?
The IUPAC name of 1-(cyclopropylmethyl)-3-morpholin-4-ylpiperidin-2-one (CID 71687081) is 1-(cyclopropylmethyl)-3-morpholin-4-ylpiperidin-2-one.
What is the SMILES notation for 1-(cyclopropylmethyl)-3-morpholin-4-ylpiperidin-2-one?
The canonical SMILES for 1-(cyclopropylmethyl)-3-morpholin-4-ylpiperidin-2-one is O=C1C(N2CCOCC2)CCCN1CC1CC1.
What is the InChIKey of 1-(cyclopropylmethyl)-3-morpholin-4-ylpiperidin-2-one?
The InChIKey is UNMFDWQHUHXJJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2O2/c16-13-12(14-6-8-17-9-7-14)2-1-5-15(13)10-11-3-4-11/h11-12H,1-10H2.
What are the key properties of 1-(cyclopropylmethyl)-3-morpholin-4-ylpiperidin-2-one?
1-(cyclopropylmethyl)-3-morpholin-4-ylpiperidin-2-one has a molecular weight of 238.33 g/mol, XLogP of 0.72, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclopropylmethyl)-3-morpholin-4-ylpiperidin-2-one is sourced from PubChem (CID 71687081), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).