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

C8H10N2O — CID 146014176

IUPAC5-(1H-pyrrol-3-yl)pyrrolidin-2-one
SMILESO=C1CCC(c2cc[nH]c2)N1
InChIInChI=1S/C8H10N2O/c11-8-2-1-7(10-8)6-3-4-9-5-6/h3-5,7,9H,1-2H2,(H,10,11)
InChIKeyVIQJRGYSFLHKCX-UHFFFAOYSA-N
MW150.18 g/mol
LogP0.97
Rot. Bonds1

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

5-(1H-pyrrol-3-yl)pyrrolidin-2-one (PubChem CID 146014176) has the molecular formula C8H10N2O and a molecular weight of 150.18 g/mol. Its IUPAC name is 5-(1H-pyrrol-3-yl)pyrrolidin-2-one.

Molecular Properties

Compound Name5-(1H-pyrrol-3-yl)pyrrolidin-2-one
PubChem CID146014176
Molecular FormulaC8H10N2O
Molecular Weight150.18 g/mol
Exact Mass150.08
IUPAC Name5-(1H-pyrrol-3-yl)pyrrolidin-2-one
SMILESO=C1CCC(c2cc[nH]c2)N1
InChIInChI=1S/C8H10N2O/c11-8-2-1-7(10-8)6-3-4-9-5-6/h3-5,7,9H,1-2H2,(H,10,11)
InChIKeyVIQJRGYSFLHKCX-UHFFFAOYSA-N
XLogP0.97
TPSA44.89 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.18
LogP ≤ 50.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 5-(1H-pyrrol-3-yl)pyrrolidin-2-one?
The IUPAC name of 5-(1H-pyrrol-3-yl)pyrrolidin-2-one (CID 146014176) is 5-(1H-pyrrol-3-yl)pyrrolidin-2-one.
What is the SMILES notation for 5-(1H-pyrrol-3-yl)pyrrolidin-2-one?
The canonical SMILES for 5-(1H-pyrrol-3-yl)pyrrolidin-2-one is O=C1CCC(c2cc[nH]c2)N1.
What is the InChIKey of 5-(1H-pyrrol-3-yl)pyrrolidin-2-one?
The InChIKey is VIQJRGYSFLHKCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2O/c11-8-2-1-7(10-8)6-3-4-9-5-6/h3-5,7,9H,1-2H2,(H,10,11).
What are the key properties of 5-(1H-pyrrol-3-yl)pyrrolidin-2-one?
5-(1H-pyrrol-3-yl)pyrrolidin-2-one has a molecular weight of 150.18 g/mol, XLogP of 0.97, 1 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1H-pyrrol-3-yl)pyrrolidin-2-one is sourced from PubChem (CID 146014176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).