1-(3,4-dihydro-2H-pyrrol-5-yl)pyrrolidin-2-one

C8H12N2O — CID 10464513

IUPAC1-(3,4-dihydro-2H-pyrrol-5-yl)pyrrolidin-2-one
SMILESO=C1CCCN1C1=NCCC1
InChIInChI=1S/C8H12N2O/c11-8-4-2-6-10(8)7-3-1-5-9-7/h1-6H2
InChIKeyCPYBTXZHLQTZNG-UHFFFAOYSA-N
MW152.20 g/mol
LogP0.80
Rot. Bonds

About 1-(3,4-dihydro-2H-pyrrol-5-yl)pyrrolidin-2-one

1-(3,4-dihydro-2H-pyrrol-5-yl)pyrrolidin-2-one (PubChem CID 10464513) has the molecular formula C8H12N2O and a molecular weight of 152.20 g/mol. Its IUPAC name is 1-(3,4-dihydro-2H-pyrrol-5-yl)pyrrolidin-2-one.

Molecular Properties

Compound Name1-(3,4-dihydro-2H-pyrrol-5-yl)pyrrolidin-2-one
PubChem CID10464513
Molecular FormulaC8H12N2O
Molecular Weight152.20 g/mol
Exact Mass152.09
IUPAC Name1-(3,4-dihydro-2H-pyrrol-5-yl)pyrrolidin-2-one
SMILESO=C1CCCN1C1=NCCC1
InChIInChI=1S/C8H12N2O/c11-8-4-2-6-10(8)7-3-1-5-9-7/h1-6H2
InChIKeyCPYBTXZHLQTZNG-UHFFFAOYSA-N
XLogP0.80
TPSA32.67 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.20
LogP ≤ 50.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(3,4-dihydro-2H-pyrrol-5-yl)pyrrolidin-2-one?
The IUPAC name of 1-(3,4-dihydro-2H-pyrrol-5-yl)pyrrolidin-2-one (CID 10464513) is 1-(3,4-dihydro-2H-pyrrol-5-yl)pyrrolidin-2-one.
What is the SMILES notation for 1-(3,4-dihydro-2H-pyrrol-5-yl)pyrrolidin-2-one?
The canonical SMILES for 1-(3,4-dihydro-2H-pyrrol-5-yl)pyrrolidin-2-one is O=C1CCCN1C1=NCCC1.
What is the InChIKey of 1-(3,4-dihydro-2H-pyrrol-5-yl)pyrrolidin-2-one?
The InChIKey is CPYBTXZHLQTZNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2O/c11-8-4-2-6-10(8)7-3-1-5-9-7/h1-6H2.
What are the key properties of 1-(3,4-dihydro-2H-pyrrol-5-yl)pyrrolidin-2-one?
1-(3,4-dihydro-2H-pyrrol-5-yl)pyrrolidin-2-one has a molecular weight of 152.20 g/mol, XLogP of 0.80, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,4-dihydro-2H-pyrrol-5-yl)pyrrolidin-2-one is sourced from PubChem (CID 10464513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).