(5S)-5-methoxypyrrolidin-2-one

C5H9NO2 — CID 40577037

IUPAC(5S)-5-methoxypyrrolidin-2-one
SMILESCO[C@H]1CCC(=O)N1
InChIInChI=1S/C5H9NO2/c1-8-5-3-2-4(7)6-5/h5H,2-3H2,1H3,(H,6,7)/t5-/m0/s1
InChIKeyVULIHENHKGDFAB-YFKPBYRVSA-N
MW115.13 g/mol
LogP-0.13
Rot. Bonds1

About (5S)-5-methoxypyrrolidin-2-one

(5S)-5-methoxypyrrolidin-2-one (PubChem CID 40577037) has the molecular formula C5H9NO2 and a molecular weight of 115.13 g/mol. Its IUPAC name is (5S)-5-methoxypyrrolidin-2-one.

Molecular Properties

Compound Name(5S)-5-methoxypyrrolidin-2-one
PubChem CID40577037
Molecular FormulaC5H9NO2
Molecular Weight115.13 g/mol
Exact Mass115.06
IUPAC Name(5S)-5-methoxypyrrolidin-2-one
SMILESCO[C@H]1CCC(=O)N1
InChIInChI=1S/C5H9NO2/c1-8-5-3-2-4(7)6-5/h5H,2-3H2,1H3,(H,6,7)/t5-/m0/s1
InChIKeyVULIHENHKGDFAB-YFKPBYRVSA-N
XLogP-0.13
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500115.13
LogP ≤ 5-0.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

Pterolactam
CID 181561
(R)-5-Hydroxy-2-pyrrolidinone
CID 178119
5-Methoxy-1-methylpyrrolidin-2-one
CID 11423602
5-Hydroxy-2-pyrrolidone
CID 194148
(5R)-5-methoxypyrrolidin-2-one
CID 643445
(5S)-5-hydroxypyrrolidin-2-one
CID 86309954
5-Ethoxy-2-pyrrolidinone
CID 3580555
5-(1-Butyloxy) pyrrolidin-2-one
CID 15696557
5-(Trifluoromethoxy)pyrrolidin-2-one
CID 123685049
5-Methoxy-3,3-dimethyl-pyrrolidin-2-one
CID 565995
N-(5-oxooxolan-2-yl)acetamide
CID 86011112
(5S)-5-ethoxypyrrolidin-2-one
CID 7098911

Frequently Asked Questions

What is the IUPAC name of (5S)-5-methoxypyrrolidin-2-one?
The IUPAC name of (5S)-5-methoxypyrrolidin-2-one (CID 40577037) is (5S)-5-methoxypyrrolidin-2-one.
What is the SMILES notation for (5S)-5-methoxypyrrolidin-2-one?
The canonical SMILES for (5S)-5-methoxypyrrolidin-2-one is CO[C@H]1CCC(=O)N1.
What is the InChIKey of (5S)-5-methoxypyrrolidin-2-one?
The InChIKey is VULIHENHKGDFAB-YFKPBYRVSA-N. The full InChI is InChI=1S/C5H9NO2/c1-8-5-3-2-4(7)6-5/h5H,2-3H2,1H3,(H,6,7)/t5-/m0/s1.
What are the key properties of (5S)-5-methoxypyrrolidin-2-one?
(5S)-5-methoxypyrrolidin-2-one has a molecular weight of 115.13 g/mol, XLogP of -0.13, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5S)-5-methoxypyrrolidin-2-one is sourced from PubChem (CID 40577037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).