N-(3,4-dimethylphenyl)-2-[3-[2-(2-oxopyrrolidin-1-yl)ethyl]-2,3-dihydroindol-1-yl]acetamide

C24H29N3O2 — CID 126784115

IUPACN-(3,4-dimethylphenyl)-2-[3-[2-(2-oxopyrrolidin-1-yl)ethyl]-2,3-dihydroindol-1-yl]acetamide
SMILESCc1ccc(NC(=O)CN2CC(CCN3CCCC3=O)c3ccccc32)cc1C
InChIInChI=1S/C24H29N3O2/c1-17-9-10-20(14-18(17)2)25-23(28)16-27-15-19(21-6-3-4-7-22(21)27)11-13-26-12-5-8-24(26)29/h3-4,6-7,9-10,14,19H,5,8,11-13,15-16H2,1-2H3,(H,25,28)
InChIKeyMQGJPRWNXWVQFF-UHFFFAOYSA-N
MW391.52 g/mol
LogP3.86
Rot. Bonds6

About N-(3,4-dimethylphenyl)-2-[3-[2-(2-oxopyrrolidin-1-yl)ethyl]-2,3-dihydroindol-1-yl]acetamide

N-(3,4-dimethylphenyl)-2-[3-[2-(2-oxopyrrolidin-1-yl)ethyl]-2,3-dihydroindol-1-yl]acetamide (PubChem CID 126784115) has the molecular formula C24H29N3O2 and a molecular weight of 391.52 g/mol. Its IUPAC name is N-(3,4-dimethylphenyl)-2-[3-[2-(2-oxopyrrolidin-1-yl)ethyl]-2,3-dihydroindol-1-yl]acetamide.

Molecular Properties

Compound NameN-(3,4-dimethylphenyl)-2-[3-[2-(2-oxopyrrolidin-1-yl)ethyl]-2,3-dihydroindol-1-yl]acetamide
PubChem CID126784115
Molecular FormulaC24H29N3O2
Molecular Weight391.52 g/mol
Exact Mass391.23
IUPAC NameN-(3,4-dimethylphenyl)-2-[3-[2-(2-oxopyrrolidin-1-yl)ethyl]-2,3-dihydroindol-1-yl]acetamide
SMILESCc1ccc(NC(=O)CN2CC(CCN3CCCC3=O)c3ccccc32)cc1C
InChIInChI=1S/C24H29N3O2/c1-17-9-10-20(14-18(17)2)25-23(28)16-27-15-19(21-6-3-4-7-22(21)27)11-13-26-12-5-8-24(26)29/h3-4,6-7,9-10,14,19H,5,8,11-13,15-16H2,1-2H3,(H,25,28)
InChIKeyMQGJPRWNXWVQFF-UHFFFAOYSA-N
XLogP3.86
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500391.52
LogP ≤ 53.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2,5-dimethylphenyl)-2-[3-[2-(2-oxopyrrolidin-1-yl)ethyl]-2,3-dihydroindol-1-yl]acetamide
CID 126793527
2-(3,4-dihydro-2H-quinolin-1-yl)-N-(3,4-dimethylphenyl)acetamide
CID 2099393
N-(3-fluoro-4-methylphenyl)-2-(2-oxopyrrolidin-1-yl)acetamide
CID 9210623
1-[2-[(3S)-1-(cyclopropanecarbonyl)-2,3-dihydroindol-3-yl]ethyl]pyrrolidin-2-one
CID 96569870
1-[2-[(3S)-1-methylsulfonyl-2,3-dihydroindol-3-yl]ethyl]pyrrolidin-2-one
CID 96567308
3-[2-(2-oxopyrrolidin-1-yl)ethyl]-N-prop-2-ynyl-2,3-dihydroindole-1-carboxamide
CID 71975520
1-[2-[(3R)-1-(5-methyl-1H-pyrazole-3-carbonyl)-2,3-dihydroindol-3-yl]ethyl]pyrrolidin-2-one
CID 96570582
N-(3,4-dimethylphenyl)-2-[(2R)-2-ethyl-2,3-dihydro-1,4-benzothiazin-4-yl]acetamide
CID 92502220
N-(4-methoxy-3-methylphenyl)-2-(2-oxopiperidin-1-yl)acetamide
CID 87032394
1-[2-[1-[[4-(difluoromethyl)phenyl]methyl]-2,3-dihydroindol-3-yl]ethyl]pyrrolidin-2-one
CID 126790858
1-[2-[(3S)-1-(1,2-oxazol-3-ylmethyl)-2,3-dihydroindol-3-yl]ethyl]pyrrolidin-2-one
CID 97083404
2-(2,3-dihydro-1,4-benzothiazin-4-yl)-N-(3,4-dimethylphenyl)acetamide
CID 8591921

Frequently Asked Questions

What is the IUPAC name of N-(3,4-dimethylphenyl)-2-[3-[2-(2-oxopyrrolidin-1-yl)ethyl]-2,3-dihydroindol-1-yl]acetamide?
The IUPAC name of N-(3,4-dimethylphenyl)-2-[3-[2-(2-oxopyrrolidin-1-yl)ethyl]-2,3-dihydroindol-1-yl]acetamide (CID 126784115) is N-(3,4-dimethylphenyl)-2-[3-[2-(2-oxopyrrolidin-1-yl)ethyl]-2,3-dihydroindol-1-yl]acetamide.
What is the SMILES notation for N-(3,4-dimethylphenyl)-2-[3-[2-(2-oxopyrrolidin-1-yl)ethyl]-2,3-dihydroindol-1-yl]acetamide?
The canonical SMILES for N-(3,4-dimethylphenyl)-2-[3-[2-(2-oxopyrrolidin-1-yl)ethyl]-2,3-dihydroindol-1-yl]acetamide is Cc1ccc(NC(=O)CN2CC(CCN3CCCC3=O)c3ccccc32)cc1C.
What is the InChIKey of N-(3,4-dimethylphenyl)-2-[3-[2-(2-oxopyrrolidin-1-yl)ethyl]-2,3-dihydroindol-1-yl]acetamide?
The InChIKey is MQGJPRWNXWVQFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H29N3O2/c1-17-9-10-20(14-18(17)2)25-23(28)16-27-15-19(21-6-3-4-7-22(21)27)11-13-26-12-5-8-24(26)29/h3-4,6-7,9-10,14,19H,5,8,11-13,15-16H2,1-2H3,(H,25,28).
What are the key properties of N-(3,4-dimethylphenyl)-2-[3-[2-(2-oxopyrrolidin-1-yl)ethyl]-2,3-dihydroindol-1-yl]acetamide?
N-(3,4-dimethylphenyl)-2-[3-[2-(2-oxopyrrolidin-1-yl)ethyl]-2,3-dihydroindol-1-yl]acetamide has a molecular weight of 391.52 g/mol, XLogP of 3.86, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dimethylphenyl)-2-[3-[2-(2-oxopyrrolidin-1-yl)ethyl]-2,3-dihydroindol-1-yl]acetamide is sourced from PubChem (CID 126784115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).