(4R)-1-acetyl-4-hydroxypyrrolidin-2-one

C6H9NO3 — CID 14889599

IUPAC(4R)-1-acetyl-4-hydroxypyrrolidin-2-one
SMILESCC(=O)N1C[C@H](O)CC1=O
InChIInChI=1S/C6H9NO3/c1-4(8)7-3-5(9)2-6(7)10/h5,9H,2-3H2,1H3/t5-/m1/s1
InChIKeyUWTRQRQULJQLKC-RXMQYKEDSA-N
MW143.14 g/mol
LogP-0.87
Rot. Bonds

About (4R)-1-acetyl-4-hydroxypyrrolidin-2-one

(4R)-1-acetyl-4-hydroxypyrrolidin-2-one (PubChem CID 14889599) has the molecular formula C6H9NO3 and a molecular weight of 143.14 g/mol. Its IUPAC name is (4R)-1-acetyl-4-hydroxypyrrolidin-2-one.

Molecular Properties

Compound Name(4R)-1-acetyl-4-hydroxypyrrolidin-2-one
PubChem CID14889599
Molecular FormulaC6H9NO3
Molecular Weight143.14 g/mol
Exact Mass143.06
IUPAC Name(4R)-1-acetyl-4-hydroxypyrrolidin-2-one
SMILESCC(=O)N1C[C@H](O)CC1=O
InChIInChI=1S/C6H9NO3/c1-4(8)7-3-5(9)2-6(7)10/h5,9H,2-3H2,1H3/t5-/m1/s1
InChIKeyUWTRQRQULJQLKC-RXMQYKEDSA-N
XLogP-0.87
TPSA57.61 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.14
LogP ≤ 5-0.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (4R)-1-acetyl-4-hydroxypyrrolidin-2-one?
The IUPAC name of (4R)-1-acetyl-4-hydroxypyrrolidin-2-one (CID 14889599) is (4R)-1-acetyl-4-hydroxypyrrolidin-2-one.
What is the SMILES notation for (4R)-1-acetyl-4-hydroxypyrrolidin-2-one?
The canonical SMILES for (4R)-1-acetyl-4-hydroxypyrrolidin-2-one is CC(=O)N1C[C@H](O)CC1=O.
What is the InChIKey of (4R)-1-acetyl-4-hydroxypyrrolidin-2-one?
The InChIKey is UWTRQRQULJQLKC-RXMQYKEDSA-N. The full InChI is InChI=1S/C6H9NO3/c1-4(8)7-3-5(9)2-6(7)10/h5,9H,2-3H2,1H3/t5-/m1/s1.
What are the key properties of (4R)-1-acetyl-4-hydroxypyrrolidin-2-one?
(4R)-1-acetyl-4-hydroxypyrrolidin-2-one has a molecular weight of 143.14 g/mol, XLogP of -0.87, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-1-acetyl-4-hydroxypyrrolidin-2-one is sourced from PubChem (CID 14889599), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).