1-(1-acetylpyrrolidin-2-yl)pyrrolidin-2-one

C10H16N2O2 — CID 91117482

IUPAC1-(1-acetylpyrrolidin-2-yl)pyrrolidin-2-one
SMILESCC(=O)N1CCCC1N1CCCC1=O
InChIInChI=1S/C10H16N2O2/c1-8(13)11-6-2-4-9(11)12-7-3-5-10(12)14/h9H,2-7H2,1H3
InChIKeyKAGDHVTUHXLYCJ-UHFFFAOYSA-N
MW196.25 g/mol
LogP0.58
Rot. Bonds1

About 1-(1-acetylpyrrolidin-2-yl)pyrrolidin-2-one

1-(1-acetylpyrrolidin-2-yl)pyrrolidin-2-one (PubChem CID 91117482) has the molecular formula C10H16N2O2 and a molecular weight of 196.25 g/mol. Its IUPAC name is 1-(1-acetylpyrrolidin-2-yl)pyrrolidin-2-one.

Molecular Properties

Compound Name1-(1-acetylpyrrolidin-2-yl)pyrrolidin-2-one
PubChem CID91117482
Molecular FormulaC10H16N2O2
Molecular Weight196.25 g/mol
Exact Mass196.12
IUPAC Name1-(1-acetylpyrrolidin-2-yl)pyrrolidin-2-one
SMILESCC(=O)N1CCCC1N1CCCC1=O
InChIInChI=1S/C10H16N2O2/c1-8(13)11-6-2-4-9(11)12-7-3-5-10(12)14/h9H,2-7H2,1H3
InChIKeyKAGDHVTUHXLYCJ-UHFFFAOYSA-N
XLogP0.58
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.25
LogP ≤ 50.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1,4-Dipyrrolidinylbutane-1,4-dione
CID 1521741
2-Pyrrolidinone, 1-(4-(1-pyrrolidinyl)butyl)-
CID 199268
Imuracetam
CID 163319
2,5-Dioxo-1-ethylhexahydro-1H-pyrrolo[1,2-a]imidazole
CID 10352076
1,1'-Ethylidenedi-2-pyrrolidinone
CID 13379697
1-[(2-Oxopyrrolidinyl)methyl]pyrrolidin-2-one
CID 4159826
N,N'-Carbonyldipyrrolidin-2-one
CID 533467
1,1'-[(Methylazanediyl)bis(methylene)]di(pyrrolidine-2,5-dione)
CID 339370
1,1'-[1,4-Piperazinediylbis(methylene)]di(2-pyrrolidinone)
CID 773400
N,N-bis[(2,5-dioxopyrrolidin-1-yl)methyl]acetamide
CID 3588259
1,1'-(Propane-1,3-diyl)di(pyrrolidin-2-one)
CID 12485480
Disuccinimidomethan
CID 20071048

Frequently Asked Questions

What is the IUPAC name of 1-(1-acetylpyrrolidin-2-yl)pyrrolidin-2-one?
The IUPAC name of 1-(1-acetylpyrrolidin-2-yl)pyrrolidin-2-one (CID 91117482) is 1-(1-acetylpyrrolidin-2-yl)pyrrolidin-2-one.
What is the SMILES notation for 1-(1-acetylpyrrolidin-2-yl)pyrrolidin-2-one?
The canonical SMILES for 1-(1-acetylpyrrolidin-2-yl)pyrrolidin-2-one is CC(=O)N1CCCC1N1CCCC1=O.
What is the InChIKey of 1-(1-acetylpyrrolidin-2-yl)pyrrolidin-2-one?
The InChIKey is KAGDHVTUHXLYCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O2/c1-8(13)11-6-2-4-9(11)12-7-3-5-10(12)14/h9H,2-7H2,1H3.
What are the key properties of 1-(1-acetylpyrrolidin-2-yl)pyrrolidin-2-one?
1-(1-acetylpyrrolidin-2-yl)pyrrolidin-2-one has a molecular weight of 196.25 g/mol, XLogP of 0.58, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-acetylpyrrolidin-2-yl)pyrrolidin-2-one is sourced from PubChem (CID 91117482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).