2-(3-methoxyphenyl)-N-(2-oxo-1,3-dihydroindol-5-yl)pyrrolidine-1-carboxamide

C20H21N3O3 — CID 72867925

IUPAC2-(3-methoxyphenyl)-N-(2-oxo-1,3-dihydroindol-5-yl)pyrrolidine-1-carboxamide
SMILESCOc1cccc(C2CCCN2C(=O)Nc2ccc3c(c2)CC(=O)N3)c1
InChIInChI=1S/C20H21N3O3/c1-26-16-5-2-4-13(11-16)18-6-3-9-23(18)20(25)21-15-7-8-17-14(10-15)12-19(24)22-17/h2,4-5,7-8,10-11,18H,3,6,9,12H2,1H3,(H,21,25)(H,22,24)
InChIKeyNNBMGRLVHBHJCA-UHFFFAOYSA-N
MW351.41 g/mol
LogP3.56
Rot. Bonds3

About 2-(3-methoxyphenyl)-N-(2-oxo-1,3-dihydroindol-5-yl)pyrrolidine-1-carboxamide

2-(3-methoxyphenyl)-N-(2-oxo-1,3-dihydroindol-5-yl)pyrrolidine-1-carboxamide (PubChem CID 72867925) has the molecular formula C20H21N3O3 and a molecular weight of 351.41 g/mol. Its IUPAC name is 2-(3-methoxyphenyl)-N-(2-oxo-1,3-dihydroindol-5-yl)pyrrolidine-1-carboxamide.

Molecular Properties

Compound Name2-(3-methoxyphenyl)-N-(2-oxo-1,3-dihydroindol-5-yl)pyrrolidine-1-carboxamide
PubChem CID72867925
Molecular FormulaC20H21N3O3
Molecular Weight351.41 g/mol
Exact Mass351.16
IUPAC Name2-(3-methoxyphenyl)-N-(2-oxo-1,3-dihydroindol-5-yl)pyrrolidine-1-carboxamide
SMILESCOc1cccc(C2CCCN2C(=O)Nc2ccc3c(c2)CC(=O)N3)c1
InChIInChI=1S/C20H21N3O3/c1-26-16-5-2-4-13(11-16)18-6-3-9-23(18)20(25)21-15-7-8-17-14(10-15)12-19(24)22-17/h2,4-5,7-8,10-11,18H,3,6,9,12H2,1H3,(H,21,25)(H,22,24)
InChIKeyNNBMGRLVHBHJCA-UHFFFAOYSA-N
XLogP3.56
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.41
LogP ≤ 53.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-bromophenyl)-2-(3-methoxyphenyl)pyrrolidine-1-carboxamide
CID 86986361
N-(3-fluoro-4-methylphenyl)-2-(3-methoxyphenyl)pyrrolidine-1-carboxamide
CID 86987034
N-(3-ethylphenyl)-2-(3-methoxyphenyl)pyrrolidine-1-carboxamide
CID 86987252
N-(1H-indazol-6-yl)-2-(3-methoxyphenyl)piperidine-1-carboxamide
CID 72906089
(2S)-2-(5-methyl-1,2-oxazol-3-yl)-N-(2-oxo-1,3-dihydroindol-5-yl)pyrrolidine-1-carboxamide
CID 97444027
(2S)-N-[6-(dimethylamino)-3-pyridinyl]-2-(3-methoxyphenyl)pyrrolidine-1-carboxamide
CID 94028579
(1S)-7-methoxy-1-methyl-N-(2-oxo-1,3-dihydroindol-5-yl)-3,4-dihydro-1H-isoquinoline-2-carboxamide
CID 97452815
N-(3-methoxyphenyl)-2-(3-methylphenyl)azepane-1-carboxamide
CID 53013061
(2S)-2-[5-(methylcarbamoyl)thiophen-2-yl]-N-(2-oxo-1,3-dihydroindol-5-yl)pyrrolidine-1-carboxamide
CID 97451689
bis[2-(3-methoxyphenyl)pyrrolidin-1-yl]methanone
CID 174863821
(2R)-N-[4-fluoro-3-(methylcarbamoyl)phenyl]-2-(3-methoxyphenyl)piperidine-1-carboxamide
CID 125172176
(2R)-N-(3,5-dimethoxyphenyl)-2-(3-methylphenyl)pyrrolidine-1-carboxamide
CID 51855985

Frequently Asked Questions

What is the IUPAC name of 2-(3-methoxyphenyl)-N-(2-oxo-1,3-dihydroindol-5-yl)pyrrolidine-1-carboxamide?
The IUPAC name of 2-(3-methoxyphenyl)-N-(2-oxo-1,3-dihydroindol-5-yl)pyrrolidine-1-carboxamide (CID 72867925) is 2-(3-methoxyphenyl)-N-(2-oxo-1,3-dihydroindol-5-yl)pyrrolidine-1-carboxamide.
What is the SMILES notation for 2-(3-methoxyphenyl)-N-(2-oxo-1,3-dihydroindol-5-yl)pyrrolidine-1-carboxamide?
The canonical SMILES for 2-(3-methoxyphenyl)-N-(2-oxo-1,3-dihydroindol-5-yl)pyrrolidine-1-carboxamide is COc1cccc(C2CCCN2C(=O)Nc2ccc3c(c2)CC(=O)N3)c1.
What is the InChIKey of 2-(3-methoxyphenyl)-N-(2-oxo-1,3-dihydroindol-5-yl)pyrrolidine-1-carboxamide?
The InChIKey is NNBMGRLVHBHJCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21N3O3/c1-26-16-5-2-4-13(11-16)18-6-3-9-23(18)20(25)21-15-7-8-17-14(10-15)12-19(24)22-17/h2,4-5,7-8,10-11,18H,3,6,9,12H2,1H3,(H,21,25)(H,22,24).
What are the key properties of 2-(3-methoxyphenyl)-N-(2-oxo-1,3-dihydroindol-5-yl)pyrrolidine-1-carboxamide?
2-(3-methoxyphenyl)-N-(2-oxo-1,3-dihydroindol-5-yl)pyrrolidine-1-carboxamide has a molecular weight of 351.41 g/mol, XLogP of 3.56, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methoxyphenyl)-N-(2-oxo-1,3-dihydroindol-5-yl)pyrrolidine-1-carboxamide is sourced from PubChem (CID 72867925), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).