1-methyl-3-phenyl-3-pyrrolidin-1-ylindol-2-one

C19H20N2O — CID 102519174

IUPAC1-methyl-3-phenyl-3-pyrrolidin-1-ylindol-2-one
SMILESCN1C(=O)C(c2ccccc2)(N2CCCC2)c2ccccc21
InChIInChI=1S/C19H20N2O/c1-20-17-12-6-5-11-16(17)19(18(20)22,21-13-7-8-14-21)15-9-3-2-4-10-15/h2-6,9-12H,7-8,13-14H2,1H3
InChIKeyYMKSNTPVUWBEAY-UHFFFAOYSA-N
MW292.38 g/mol
LogP3.00
Rot. Bonds2

About 1-methyl-3-phenyl-3-pyrrolidin-1-ylindol-2-one

1-methyl-3-phenyl-3-pyrrolidin-1-ylindol-2-one (PubChem CID 102519174) has the molecular formula C19H20N2O and a molecular weight of 292.38 g/mol. Its IUPAC name is 1-methyl-3-phenyl-3-pyrrolidin-1-ylindol-2-one.

Molecular Properties

Compound Name1-methyl-3-phenyl-3-pyrrolidin-1-ylindol-2-one
PubChem CID102519174
Molecular FormulaC19H20N2O
Molecular Weight292.38 g/mol
Exact Mass292.16
IUPAC Name1-methyl-3-phenyl-3-pyrrolidin-1-ylindol-2-one
SMILESCN1C(=O)C(c2ccccc2)(N2CCCC2)c2ccccc21
InChIInChI=1S/C19H20N2O/c1-20-17-12-6-5-11-16(17)19(18(20)22,21-13-7-8-14-21)15-9-3-2-4-10-15/h2-6,9-12H,7-8,13-14H2,1H3
InChIKeyYMKSNTPVUWBEAY-UHFFFAOYSA-N
XLogP3.00
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 53.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-(benzenesulfonyl)-3-phenyl-3-pyrrolidin-1-ylindol-2-one
CID 154271226
1,3,3,4,4-pentamethylquinolin-2-one
CID 57425073
2-phenyl-2-piperidin-1-ylindene-1,3-dione
CID 2849345
1'-methylspiro[cyclopropane-1,3'-indole]-2'-one
CID 14317864
2-amino-1'-methylspiro[cyclopropane-1,3'-indole]-2'-one
CID 84719129
1-methyl-1'-(pyrrolidine-1-carbonyl)spiro[indole-3,4'-piperidine]-2-one
CID 97452604
1,3',3'-trimethylspiro[indole-3,2'-oxirane]-2-one
CID 102309588
CID 59909654
CID 59909654
(3R)-3-hydroxy-1,3-dimethylindol-2-one
CID 102086681
(3R)-1'-(benzenesulfonyl)-1-methylspiro[indole-3,3'-piperidine]-2-one
CID 95716062
3-(cyclohexylmethyl)-1,3-dimethylindol-2-one
CID 102226125
1'-methylspiro[cyclohexene-4,3'-indole]-2'-one
CID 12024416

Frequently Asked Questions

What is the IUPAC name of 1-methyl-3-phenyl-3-pyrrolidin-1-ylindol-2-one?
The IUPAC name of 1-methyl-3-phenyl-3-pyrrolidin-1-ylindol-2-one (CID 102519174) is 1-methyl-3-phenyl-3-pyrrolidin-1-ylindol-2-one.
What is the SMILES notation for 1-methyl-3-phenyl-3-pyrrolidin-1-ylindol-2-one?
The canonical SMILES for 1-methyl-3-phenyl-3-pyrrolidin-1-ylindol-2-one is CN1C(=O)C(c2ccccc2)(N2CCCC2)c2ccccc21.
What is the InChIKey of 1-methyl-3-phenyl-3-pyrrolidin-1-ylindol-2-one?
The InChIKey is YMKSNTPVUWBEAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O/c1-20-17-12-6-5-11-16(17)19(18(20)22,21-13-7-8-14-21)15-9-3-2-4-10-15/h2-6,9-12H,7-8,13-14H2,1H3.
What are the key properties of 1-methyl-3-phenyl-3-pyrrolidin-1-ylindol-2-one?
1-methyl-3-phenyl-3-pyrrolidin-1-ylindol-2-one has a molecular weight of 292.38 g/mol, XLogP of 3.00, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-3-phenyl-3-pyrrolidin-1-ylindol-2-one is sourced from PubChem (CID 102519174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).