(3R)-3-ethylpyrrolidin-2-one

C6H11NO — CID 641536

IUPAC(3R)-3-ethylpyrrolidin-2-one
SMILESCC[C@@H]1CCNC1=O
InChIInChI=1S/C6H11NO/c1-2-5-3-4-7-6(5)8/h5H,2-4H2,1H3,(H,7,8)/t5-/m1/s1
InChIKeyZRBMHTFPJMSUDJ-RXMQYKEDSA-N
MW113.16 g/mol
LogP0.53
Rot. Bonds1

About (3R)-3-ethylpyrrolidin-2-one

(3R)-3-ethylpyrrolidin-2-one (PubChem CID 641536) has the molecular formula C6H11NO and a molecular weight of 113.16 g/mol. Its IUPAC name is (3R)-3-ethylpyrrolidin-2-one.

Molecular Properties

Compound Name(3R)-3-ethylpyrrolidin-2-one
PubChem CID641536
Molecular FormulaC6H11NO
Molecular Weight113.16 g/mol
Exact Mass113.08
IUPAC Name(3R)-3-ethylpyrrolidin-2-one
SMILESCC[C@@H]1CCNC1=O
InChIInChI=1S/C6H11NO/c1-2-5-3-4-7-6(5)8/h5H,2-4H2,1H3,(H,7,8)/t5-/m1/s1
InChIKeyZRBMHTFPJMSUDJ-RXMQYKEDSA-N
XLogP0.53
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500113.16
LogP ≤ 50.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3,3-Diethyl-2-pyrrolidinone
CID 9793807
3-Methylpyrrolidin-2-one
CID 102848
3-Ethyl-2-pyrrolidinone
CID 18442682
5-Methyl-2-pyrrolidone
CID 66055
(5R)-5-Methyl-2-pyrrolidinone
CID 643473
(5S)-5-Methyl-2-pyrrolidinone
CID 7458701
4-Methyl-2-pyrrolidinone
CID 533920
3,3-Dimethylpyrrolidin-2-one
CID 5114908
4-(Propan-2-yl)pyrrolidin-2-one
CID 20976007
3-Ethyl-3-methylpyrrolidin-2-one
CID 21634101
(5S)-5-(propan-2-yl)pyrrolidin-2-one
CID 13082303
4,4-Dimethyl-2-pyrrolidinone
CID 637593

Frequently Asked Questions

What is the IUPAC name of (3R)-3-ethylpyrrolidin-2-one?
The IUPAC name of (3R)-3-ethylpyrrolidin-2-one (CID 641536) is (3R)-3-ethylpyrrolidin-2-one.
What is the SMILES notation for (3R)-3-ethylpyrrolidin-2-one?
The canonical SMILES for (3R)-3-ethylpyrrolidin-2-one is CC[C@@H]1CCNC1=O.
What is the InChIKey of (3R)-3-ethylpyrrolidin-2-one?
The InChIKey is ZRBMHTFPJMSUDJ-RXMQYKEDSA-N. The full InChI is InChI=1S/C6H11NO/c1-2-5-3-4-7-6(5)8/h5H,2-4H2,1H3,(H,7,8)/t5-/m1/s1.
What are the key properties of (3R)-3-ethylpyrrolidin-2-one?
(3R)-3-ethylpyrrolidin-2-one has a molecular weight of 113.16 g/mol, XLogP of 0.53, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-ethylpyrrolidin-2-one is sourced from PubChem (CID 641536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).