5-pyrrolidin-1-yl-1,3-dihydroindol-2-one

C12H14N2O — CID 23363883

IUPAC5-pyrrolidin-1-yl-1,3-dihydroindol-2-one
SMILESO=C1Cc2cc(N3CCCC3)ccc2N1
InChIInChI=1S/C12H14N2O/c15-12-8-9-7-10(3-4-11(9)13-12)14-5-1-2-6-14/h3-4,7H,1-2,5-6,8H2,(H,13,15)
InChIKeyOSNDRSCPINUHAR-UHFFFAOYSA-N
MW202.26 g/mol
LogP1.78
Rot. Bonds1

About 5-pyrrolidin-1-yl-1,3-dihydroindol-2-one

5-pyrrolidin-1-yl-1,3-dihydroindol-2-one (PubChem CID 23363883) has the molecular formula C12H14N2O and a molecular weight of 202.26 g/mol. Its IUPAC name is 5-pyrrolidin-1-yl-1,3-dihydroindol-2-one.

Molecular Properties

Compound Name5-pyrrolidin-1-yl-1,3-dihydroindol-2-one
PubChem CID23363883
Molecular FormulaC12H14N2O
Molecular Weight202.26 g/mol
Exact Mass202.11
IUPAC Name5-pyrrolidin-1-yl-1,3-dihydroindol-2-one
SMILESO=C1Cc2cc(N3CCCC3)ccc2N1
InChIInChI=1S/C12H14N2O/c15-12-8-9-7-10(3-4-11(9)13-12)14-5-1-2-6-14/h3-4,7H,1-2,5-6,8H2,(H,13,15)
InChIKeyOSNDRSCPINUHAR-UHFFFAOYSA-N
XLogP1.78
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.26
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}

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Related Compounds

1-(2-oxo-1,3-dihydroindol-5-yl)piperidine-3-carboxylic acid
CID 117099453
6-pyrrolidin-1-yl-3,4-dihydro-1H-quinazolin-2-one
CID 168515878
5-[4-(4-methoxybenzoyl)piperazin-1-yl]-1,3-dihydroindol-2-one
CID 110414687
6-pyrrolidin-1-yl-1H-indole-2,3-dione
CID 39871032
benzyl 4-(2-oxo-1,3-dihydroindol-5-yl)piperazine-1-carboxylate
CID 110414727
N-[4-(4-acetylpiperazin-1-yl)phenyl]-2-oxo-1,3-dihydroindole-5-sulfonamide
CID 44825291
6-(4-aminopiperidin-1-yl)-3,4-dihydro-1H-quinolin-2-one
CID 14627677
6-[4-[(E)-but-2-enyl]piperazin-1-yl]-3,4-dihydro-1H-quinolin-2-one
CID 13236323
ethane;5-methyl-1,3-dihydroindol-2-one
CID 91234498
3,3-dimethyl-7-pyrrolidin-1-yl-2,4-dihydroisoquinolin-1-one
CID 168514747
5-(1-amino-2-oxo-2-pyrrolidin-1-ylethyl)-1,3-dihydroindol-2-one
CID 116851314
5-(oxazinane-2-carbonyl)-1,3-dihydroindol-2-one
CID 102711392

Frequently Asked Questions

What is the IUPAC name of 5-pyrrolidin-1-yl-1,3-dihydroindol-2-one?
The IUPAC name of 5-pyrrolidin-1-yl-1,3-dihydroindol-2-one (CID 23363883) is 5-pyrrolidin-1-yl-1,3-dihydroindol-2-one.
What is the SMILES notation for 5-pyrrolidin-1-yl-1,3-dihydroindol-2-one?
The canonical SMILES for 5-pyrrolidin-1-yl-1,3-dihydroindol-2-one is O=C1Cc2cc(N3CCCC3)ccc2N1.
What is the InChIKey of 5-pyrrolidin-1-yl-1,3-dihydroindol-2-one?
The InChIKey is OSNDRSCPINUHAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O/c15-12-8-9-7-10(3-4-11(9)13-12)14-5-1-2-6-14/h3-4,7H,1-2,5-6,8H2,(H,13,15).
What are the key properties of 5-pyrrolidin-1-yl-1,3-dihydroindol-2-one?
5-pyrrolidin-1-yl-1,3-dihydroindol-2-one has a molecular weight of 202.26 g/mol, XLogP of 1.78, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-pyrrolidin-1-yl-1,3-dihydroindol-2-one is sourced from PubChem (CID 23363883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).