(5S)-5-[4-(2-morpholin-4-yl-2-oxoethyl)piperazine-1-carbonyl]pyrrolidin-2-one

C15H24N4O4 — CID 139824573

IUPAC(5S)-5-[4-(2-morpholin-4-yl-2-oxoethyl)piperazine-1-carbonyl]pyrrolidin-2-one
SMILESO=C1CC[C@@H](C(=O)N2CCN(CC(=O)N3CCOCC3)CC2)N1
InChIInChI=1S/C15H24N4O4/c20-13-2-1-12(16-13)15(22)19-5-3-17(4-6-19)11-14(21)18-7-9-23-10-8-18/h12H,1-11H2,(H,16,20)/t12-/m0/s1
InChIKeyIGUYYHAFNYFSEJ-LBPRGKRZSA-N
MW324.38 g/mol
LogP-1.73
Rot. Bonds3

About (5S)-5-[4-(2-morpholin-4-yl-2-oxoethyl)piperazine-1-carbonyl]pyrrolidin-2-one

(5S)-5-[4-(2-morpholin-4-yl-2-oxoethyl)piperazine-1-carbonyl]pyrrolidin-2-one (PubChem CID 139824573) has the molecular formula C15H24N4O4 and a molecular weight of 324.38 g/mol. Its IUPAC name is (5S)-5-[4-(2-morpholin-4-yl-2-oxoethyl)piperazine-1-carbonyl]pyrrolidin-2-one.

Molecular Properties

Compound Name(5S)-5-[4-(2-morpholin-4-yl-2-oxoethyl)piperazine-1-carbonyl]pyrrolidin-2-one
PubChem CID139824573
Molecular FormulaC15H24N4O4
Molecular Weight324.38 g/mol
Exact Mass324.18
IUPAC Name(5S)-5-[4-(2-morpholin-4-yl-2-oxoethyl)piperazine-1-carbonyl]pyrrolidin-2-one
SMILESO=C1CC[C@@H](C(=O)N2CCN(CC(=O)N3CCOCC3)CC2)N1
InChIInChI=1S/C15H24N4O4/c20-13-2-1-12(16-13)15(22)19-5-3-17(4-6-19)11-14(21)18-7-9-23-10-8-18/h12H,1-11H2,(H,16,20)/t12-/m0/s1
InChIKeyIGUYYHAFNYFSEJ-LBPRGKRZSA-N
XLogP-1.73
TPSA82.19 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.38
LogP ≤ 5-1.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of (5S)-5-[4-(2-morpholin-4-yl-2-oxoethyl)piperazine-1-carbonyl]pyrrolidin-2-one?
The IUPAC name of (5S)-5-[4-(2-morpholin-4-yl-2-oxoethyl)piperazine-1-carbonyl]pyrrolidin-2-one (CID 139824573) is (5S)-5-[4-(2-morpholin-4-yl-2-oxoethyl)piperazine-1-carbonyl]pyrrolidin-2-one.
What is the SMILES notation for (5S)-5-[4-(2-morpholin-4-yl-2-oxoethyl)piperazine-1-carbonyl]pyrrolidin-2-one?
The canonical SMILES for (5S)-5-[4-(2-morpholin-4-yl-2-oxoethyl)piperazine-1-carbonyl]pyrrolidin-2-one is O=C1CC[C@@H](C(=O)N2CCN(CC(=O)N3CCOCC3)CC2)N1.
What is the InChIKey of (5S)-5-[4-(2-morpholin-4-yl-2-oxoethyl)piperazine-1-carbonyl]pyrrolidin-2-one?
The InChIKey is IGUYYHAFNYFSEJ-LBPRGKRZSA-N. The full InChI is InChI=1S/C15H24N4O4/c20-13-2-1-12(16-13)15(22)19-5-3-17(4-6-19)11-14(21)18-7-9-23-10-8-18/h12H,1-11H2,(H,16,20)/t12-/m0/s1.
What are the key properties of (5S)-5-[4-(2-morpholin-4-yl-2-oxoethyl)piperazine-1-carbonyl]pyrrolidin-2-one?
(5S)-5-[4-(2-morpholin-4-yl-2-oxoethyl)piperazine-1-carbonyl]pyrrolidin-2-one has a molecular weight of 324.38 g/mol, XLogP of -1.73, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (5S)-5-[4-(2-morpholin-4-yl-2-oxoethyl)piperazine-1-carbonyl]pyrrolidin-2-one is sourced from PubChem (CID 139824573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).