3-[3-oxo-3-(5-pyrrolidin-1-yl-2,3-dihydroindol-1-yl)propyl]-1H-quinolin-2-one

C24H25N3O2 — CID 110355057

IUPAC3-[3-oxo-3-(5-pyrrolidin-1-yl-2,3-dihydroindol-1-yl)propyl]-1H-quinolin-2-one
SMILESO=C(CCc1cc2ccccc2[nH]c1=O)N1CCc2cc(N3CCCC3)ccc21
InChIInChI=1S/C24H25N3O2/c28-23(10-7-19-15-17-5-1-2-6-21(17)25-24(19)29)27-14-11-18-16-20(8-9-22(18)27)26-12-3-4-13-26/h1-2,5-6,8-9,15-16H,3-4,7,10-14H2,(H,25,29)
InChIKeyUQKINPFGKZENTH-UHFFFAOYSA-N
MW387.48 g/mol
LogP3.65
Rot. Bonds4

About 3-[3-oxo-3-(5-pyrrolidin-1-yl-2,3-dihydroindol-1-yl)propyl]-1H-quinolin-2-one

3-[3-oxo-3-(5-pyrrolidin-1-yl-2,3-dihydroindol-1-yl)propyl]-1H-quinolin-2-one (PubChem CID 110355057) has the molecular formula C24H25N3O2 and a molecular weight of 387.48 g/mol. Its IUPAC name is 3-[3-oxo-3-(5-pyrrolidin-1-yl-2,3-dihydroindol-1-yl)propyl]-1H-quinolin-2-one.

Molecular Properties

Compound Name3-[3-oxo-3-(5-pyrrolidin-1-yl-2,3-dihydroindol-1-yl)propyl]-1H-quinolin-2-one
PubChem CID110355057
Molecular FormulaC24H25N3O2
Molecular Weight387.48 g/mol
Exact Mass387.19
IUPAC Name3-[3-oxo-3-(5-pyrrolidin-1-yl-2,3-dihydroindol-1-yl)propyl]-1H-quinolin-2-one
SMILESO=C(CCc1cc2ccccc2[nH]c1=O)N1CCc2cc(N3CCCC3)ccc21
InChIInChI=1S/C24H25N3O2/c28-23(10-7-19-15-17-5-1-2-6-21(17)25-24(19)29)27-14-11-18-16-20(8-9-22(18)27)26-12-3-4-13-26/h1-2,5-6,8-9,15-16H,3-4,7,10-14H2,(H,25,29)
InChIKeyUQKINPFGKZENTH-UHFFFAOYSA-N
XLogP3.65
TPSA56.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.48
LogP ≤ 53.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 3-[3-oxo-3-(5-pyrrolidin-1-yl-2,3-dihydroindol-1-yl)propyl]-1H-quinolin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-[2-(5-chloro-2,3-dihydroindol-1-yl)-2-oxoethyl]-1H-quinolin-2-one
CID 167947111
3-[[(1-acetyl-2,3-dihydroindol-5-yl)amino]methyl]-1H-quinolin-2-one
CID 86812574
3-(4-methoxyphenyl)-1-(5-pyrrolidin-1-yl-2,3-dihydroindol-1-yl)propan-1-one
CID 110316014
3-[3-[4-(3-methylphenyl)piperazin-1-yl]-3-oxopropyl]-1H-quinolin-2-one
CID 110330988
1-acetyl-N-[(2-oxo-1H-quinolin-3-yl)methyl]-2,3-dihydroindole-5-sulfonamide
CID 110324349
3-[3-(3,4-dihydro-2H-quinolin-1-yl)-3-oxopropyl]-6,7-dimethoxy-1H-quinolin-2-one
CID 110298983
3-[3-(2-ethylpiperidin-1-yl)-3-oxopropyl]-1H-quinolin-2-one
CID 110355917
1-(5-piperazin-1-yl-2,3-dihydroindol-1-yl)butan-1-one
CID 28707300
ethyl 5-pyrrolidin-1-yl-2,3-dihydroindole-1-carboxylate
CID 110316008
3-[3-[3-(furan-2-yl)pyrrolidin-1-yl]-3-oxopropyl]-1H-quinolin-2-one
CID 110424560
3-(3-fluorophenyl)-1-(5-morpholin-4-yl-2,3-dihydroindol-1-yl)propan-1-one
CID 110634561
7-methyl-3-(3-oxo-3-pyrrolidin-1-ylpropyl)-1H-quinolin-2-one
CID 53174869

Frequently Asked Questions

What is the IUPAC name of 3-[3-oxo-3-(5-pyrrolidin-1-yl-2,3-dihydroindol-1-yl)propyl]-1H-quinolin-2-one?
The IUPAC name of 3-[3-oxo-3-(5-pyrrolidin-1-yl-2,3-dihydroindol-1-yl)propyl]-1H-quinolin-2-one (CID 110355057) is 3-[3-oxo-3-(5-pyrrolidin-1-yl-2,3-dihydroindol-1-yl)propyl]-1H-quinolin-2-one.
What is the SMILES notation for 3-[3-oxo-3-(5-pyrrolidin-1-yl-2,3-dihydroindol-1-yl)propyl]-1H-quinolin-2-one?
The canonical SMILES for 3-[3-oxo-3-(5-pyrrolidin-1-yl-2,3-dihydroindol-1-yl)propyl]-1H-quinolin-2-one is O=C(CCc1cc2ccccc2[nH]c1=O)N1CCc2cc(N3CCCC3)ccc21.
What is the InChIKey of 3-[3-oxo-3-(5-pyrrolidin-1-yl-2,3-dihydroindol-1-yl)propyl]-1H-quinolin-2-one?
The InChIKey is UQKINPFGKZENTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25N3O2/c28-23(10-7-19-15-17-5-1-2-6-21(17)25-24(19)29)27-14-11-18-16-20(8-9-22(18)27)26-12-3-4-13-26/h1-2,5-6,8-9,15-16H,3-4,7,10-14H2,(H,25,29).
What are the key properties of 3-[3-oxo-3-(5-pyrrolidin-1-yl-2,3-dihydroindol-1-yl)propyl]-1H-quinolin-2-one?
3-[3-oxo-3-(5-pyrrolidin-1-yl-2,3-dihydroindol-1-yl)propyl]-1H-quinolin-2-one has a molecular weight of 387.48 g/mol, XLogP of 3.65, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3-oxo-3-(5-pyrrolidin-1-yl-2,3-dihydroindol-1-yl)propyl]-1H-quinolin-2-one is sourced from PubChem (CID 110355057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).