N-(2,3-dimethylphenyl)-2-[[2-(2-methyl-2,3-dihydroindol-1-yl)acetyl]amino]acetamide

C21H25N3O2 — CID 17467252

IUPACN-(2,3-dimethylphenyl)-2-[[2-(2-methyl-2,3-dihydroindol-1-yl)acetyl]amino]acetamide
SMILESCc1cccc(NC(=O)CNC(=O)CN2c3ccccc3CC2C)c1C
InChIInChI=1S/C21H25N3O2/c1-14-7-6-9-18(16(14)3)23-20(25)12-22-21(26)13-24-15(2)11-17-8-4-5-10-19(17)24/h4-10,15H,11-13H2,1-3H3,(H,22,26)(H,23,25)
InChIKeyKNSHKGDGXUDHGW-UHFFFAOYSA-N
MW351.45 g/mol
LogP2.81
Rot. Bonds5

About N-(2,3-dimethylphenyl)-2-[[2-(2-methyl-2,3-dihydroindol-1-yl)acetyl]amino]acetamide

N-(2,3-dimethylphenyl)-2-[[2-(2-methyl-2,3-dihydroindol-1-yl)acetyl]amino]acetamide (PubChem CID 17467252) has the molecular formula C21H25N3O2 and a molecular weight of 351.45 g/mol. Its IUPAC name is N-(2,3-dimethylphenyl)-2-[[2-(2-methyl-2,3-dihydroindol-1-yl)acetyl]amino]acetamide.

Molecular Properties

Compound NameN-(2,3-dimethylphenyl)-2-[[2-(2-methyl-2,3-dihydroindol-1-yl)acetyl]amino]acetamide
PubChem CID17467252
Molecular FormulaC21H25N3O2
Molecular Weight351.45 g/mol
Exact Mass351.19
IUPAC NameN-(2,3-dimethylphenyl)-2-[[2-(2-methyl-2,3-dihydroindol-1-yl)acetyl]amino]acetamide
SMILESCc1cccc(NC(=O)CNC(=O)CN2c3ccccc3CC2C)c1C
InChIInChI=1S/C21H25N3O2/c1-14-7-6-9-18(16(14)3)23-20(25)12-22-21(26)13-24-15(2)11-17-8-4-5-10-19(17)24/h4-10,15H,11-13H2,1-3H3,(H,22,26)(H,23,25)
InChIKeyKNSHKGDGXUDHGW-UHFFFAOYSA-N
XLogP2.81
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.45
LogP ≤ 52.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(2R)-2-methyl-2,3-dihydroindol-1-yl]-N-naphthalen-1-ylacetamide
CID 25357225
2-[(2S)-2-methyl-2,3-dihydroindol-1-yl]-N-[2-(trifluoromethyl)phenyl]acetamide
CID 8686273
2-[(2R)-2-methyl-2,3-dihydroindol-1-yl]-N-(2-propan-2-ylphenyl)acetamide
CID 2652884
N-(2-methoxyphenyl)-2-[(2S)-2-methyl-2,3-dihydroindol-1-yl]acetamide
CID 25346939
N-(5-fluoro-2-methylphenyl)-2-(2-methyl-2,3-dihydroindol-1-yl)acetamide
CID 18084849
N-(2,3-dimethylphenyl)-2-[[2-[(3R,5R)-3,5-dimethylpiperidin-1-yl]acetyl]amino]acetamide
CID 8929916
2-[(2S)-2-methyl-2,3-dihydroindol-1-yl]-N-(3-methylphenyl)acetamide
CID 2652852
N-(2,6-diethylphenyl)-2-(2-methyl-2,3-dihydroindol-1-yl)acetamide
CID 22199993
N-(3-methylbutan-2-yl)-2-(2-methyl-2,3-dihydroindol-1-yl)acetamide
CID 86908313
N-(2,3-dimethylphenyl)-2-[[2-[4-(2-methoxyphenyl)piperazin-1-yl]acetyl]amino]acetamide
CID 8687125
N-(ethylcarbamoyl)-2-[(2R)-2-methyl-2,3-dihydroindol-1-yl]acetamide
CID 8685970
N-butan-2-yl-2-(2-methyl-2,3-dihydroindol-1-yl)acetamide
CID 47106290

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dimethylphenyl)-2-[[2-(2-methyl-2,3-dihydroindol-1-yl)acetyl]amino]acetamide?
The IUPAC name of N-(2,3-dimethylphenyl)-2-[[2-(2-methyl-2,3-dihydroindol-1-yl)acetyl]amino]acetamide (CID 17467252) is N-(2,3-dimethylphenyl)-2-[[2-(2-methyl-2,3-dihydroindol-1-yl)acetyl]amino]acetamide.
What is the SMILES notation for N-(2,3-dimethylphenyl)-2-[[2-(2-methyl-2,3-dihydroindol-1-yl)acetyl]amino]acetamide?
The canonical SMILES for N-(2,3-dimethylphenyl)-2-[[2-(2-methyl-2,3-dihydroindol-1-yl)acetyl]amino]acetamide is Cc1cccc(NC(=O)CNC(=O)CN2c3ccccc3CC2C)c1C.
What is the InChIKey of N-(2,3-dimethylphenyl)-2-[[2-(2-methyl-2,3-dihydroindol-1-yl)acetyl]amino]acetamide?
The InChIKey is KNSHKGDGXUDHGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H25N3O2/c1-14-7-6-9-18(16(14)3)23-20(25)12-22-21(26)13-24-15(2)11-17-8-4-5-10-19(17)24/h4-10,15H,11-13H2,1-3H3,(H,22,26)(H,23,25).
What are the key properties of N-(2,3-dimethylphenyl)-2-[[2-(2-methyl-2,3-dihydroindol-1-yl)acetyl]amino]acetamide?
N-(2,3-dimethylphenyl)-2-[[2-(2-methyl-2,3-dihydroindol-1-yl)acetyl]amino]acetamide has a molecular weight of 351.45 g/mol, XLogP of 2.81, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dimethylphenyl)-2-[[2-(2-methyl-2,3-dihydroindol-1-yl)acetyl]amino]acetamide is sourced from PubChem (CID 17467252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).