1-cyclohexyl-4-(morpholine-4-carbonyl)pyrrolidin-2-one

C15H24N2O3 — CID 2989312

IUPAC1-cyclohexyl-4-(morpholine-4-carbonyl)pyrrolidin-2-one
SMILESO=C(C1CC(=O)N(C2CCCCC2)C1)N1CCOCC1
InChIInChI=1S/C15H24N2O3/c18-14-10-12(15(19)16-6-8-20-9-7-16)11-17(14)13-4-2-1-3-5-13/h12-13H,1-11H2
InChIKeyBUXKEGUDXPRVLJ-UHFFFAOYSA-N
MW280.37 g/mol
LogP1.03
Rot. Bonds2

About 1-cyclohexyl-4-(morpholine-4-carbonyl)pyrrolidin-2-one

1-cyclohexyl-4-(morpholine-4-carbonyl)pyrrolidin-2-one (PubChem CID 2989312) has the molecular formula C15H24N2O3 and a molecular weight of 280.37 g/mol. Its IUPAC name is 1-cyclohexyl-4-(morpholine-4-carbonyl)pyrrolidin-2-one.

Molecular Properties

Compound Name1-cyclohexyl-4-(morpholine-4-carbonyl)pyrrolidin-2-one
PubChem CID2989312
Molecular FormulaC15H24N2O3
Molecular Weight280.37 g/mol
Exact Mass280.18
IUPAC Name1-cyclohexyl-4-(morpholine-4-carbonyl)pyrrolidin-2-one
SMILESO=C(C1CC(=O)N(C2CCCCC2)C1)N1CCOCC1
InChIInChI=1S/C15H24N2O3/c18-14-10-12(15(19)16-6-8-20-9-7-16)11-17(14)13-4-2-1-3-5-13/h12-13H,1-11H2
InChIKeyBUXKEGUDXPRVLJ-UHFFFAOYSA-N
XLogP1.03
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.37
LogP ≤ 51.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-4-(morpholine-4-carbonyl)pyrrolidin-2-one?
The IUPAC name of 1-cyclohexyl-4-(morpholine-4-carbonyl)pyrrolidin-2-one (CID 2989312) is 1-cyclohexyl-4-(morpholine-4-carbonyl)pyrrolidin-2-one.
What is the SMILES notation for 1-cyclohexyl-4-(morpholine-4-carbonyl)pyrrolidin-2-one?
The canonical SMILES for 1-cyclohexyl-4-(morpholine-4-carbonyl)pyrrolidin-2-one is O=C(C1CC(=O)N(C2CCCCC2)C1)N1CCOCC1.
What is the InChIKey of 1-cyclohexyl-4-(morpholine-4-carbonyl)pyrrolidin-2-one?
The InChIKey is BUXKEGUDXPRVLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O3/c18-14-10-12(15(19)16-6-8-20-9-7-16)11-17(14)13-4-2-1-3-5-13/h12-13H,1-11H2.
What are the key properties of 1-cyclohexyl-4-(morpholine-4-carbonyl)pyrrolidin-2-one?
1-cyclohexyl-4-(morpholine-4-carbonyl)pyrrolidin-2-one has a molecular weight of 280.37 g/mol, XLogP of 1.03, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-4-(morpholine-4-carbonyl)pyrrolidin-2-one is sourced from PubChem (CID 2989312), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).