N-(2,6-diethylphenyl)-2-(2-methyl-2,3-dihydroindol-1-yl)acetamide

C21H26N2O — CID 22199993

IUPACN-(2,6-diethylphenyl)-2-(2-methyl-2,3-dihydroindol-1-yl)acetamide
SMILESCCc1cccc(CC)c1NC(=O)CN1c2ccccc2CC1C
InChIInChI=1S/C21H26N2O/c1-4-16-10-8-11-17(5-2)21(16)22-20(24)14-23-15(3)13-18-9-6-7-12-19(18)23/h6-12,15H,4-5,13-14H2,1-3H3,(H,22,24)
InChIKeyBAYUJCPDWXFZHN-UHFFFAOYSA-N
MW322.45 g/mol
LogP4.20
Rot. Bonds5

About N-(2,6-diethylphenyl)-2-(2-methyl-2,3-dihydroindol-1-yl)acetamide

N-(2,6-diethylphenyl)-2-(2-methyl-2,3-dihydroindol-1-yl)acetamide (PubChem CID 22199993) has the molecular formula C21H26N2O and a molecular weight of 322.45 g/mol. Its IUPAC name is N-(2,6-diethylphenyl)-2-(2-methyl-2,3-dihydroindol-1-yl)acetamide.

Molecular Properties

Compound NameN-(2,6-diethylphenyl)-2-(2-methyl-2,3-dihydroindol-1-yl)acetamide
PubChem CID22199993
Molecular FormulaC21H26N2O
Molecular Weight322.45 g/mol
Exact Mass322.20
IUPAC NameN-(2,6-diethylphenyl)-2-(2-methyl-2,3-dihydroindol-1-yl)acetamide
SMILESCCc1cccc(CC)c1NC(=O)CN1c2ccccc2CC1C
InChIInChI=1S/C21H26N2O/c1-4-16-10-8-11-17(5-2)21(16)22-20(24)14-23-15(3)13-18-9-6-7-12-19(18)23/h6-12,15H,4-5,13-14H2,1-3H3,(H,22,24)
InChIKeyBAYUJCPDWXFZHN-UHFFFAOYSA-N
XLogP4.20
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.45
LogP ≤ 54.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(2R)-2-methyl-2,3-dihydroindol-1-yl]-N-naphthalen-1-ylacetamide
CID 25357225
N-butan-2-yl-2-(2-methyl-2,3-dihydroindol-1-yl)acetamide
CID 47106290
2-[(2S)-2-methyl-2,3-dihydroindol-1-yl]-N-(3-methylphenyl)acetamide
CID 2652852
N-(2-fluorophenyl)-2-[(2R)-2-methyl-2,3-dihydroindol-1-yl]acetamide
CID 2652898
2-[(2S)-2-methyl-2,3-dihydroindol-1-yl]-N-[2-(trifluoromethyl)phenyl]acetamide
CID 8686273
N-(3-methylbutan-2-yl)-2-(2-methyl-2,3-dihydroindol-1-yl)acetamide
CID 86908313
N-(ethylcarbamoyl)-2-[(2R)-2-methyl-2,3-dihydroindol-1-yl]acetamide
CID 8685970
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
4-[[2-(2-methyl-2,3-dihydroindol-1-yl)acetyl]amino]benzamide
CID 4818217
N-(4-cyanophenyl)-2-[(2R)-2-methyl-2,3-dihydroindol-1-yl]acetamide
CID 2161891
N-(2-cyanophenyl)-2-[(2S)-2-methyl-2,3-dihydroindol-1-yl]acetamide
CID 2503334

Frequently Asked Questions

What is the IUPAC name of N-(2,6-diethylphenyl)-2-(2-methyl-2,3-dihydroindol-1-yl)acetamide?
The IUPAC name of N-(2,6-diethylphenyl)-2-(2-methyl-2,3-dihydroindol-1-yl)acetamide (CID 22199993) is N-(2,6-diethylphenyl)-2-(2-methyl-2,3-dihydroindol-1-yl)acetamide.
What is the SMILES notation for N-(2,6-diethylphenyl)-2-(2-methyl-2,3-dihydroindol-1-yl)acetamide?
The canonical SMILES for N-(2,6-diethylphenyl)-2-(2-methyl-2,3-dihydroindol-1-yl)acetamide is CCc1cccc(CC)c1NC(=O)CN1c2ccccc2CC1C.
What is the InChIKey of N-(2,6-diethylphenyl)-2-(2-methyl-2,3-dihydroindol-1-yl)acetamide?
The InChIKey is BAYUJCPDWXFZHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H26N2O/c1-4-16-10-8-11-17(5-2)21(16)22-20(24)14-23-15(3)13-18-9-6-7-12-19(18)23/h6-12,15H,4-5,13-14H2,1-3H3,(H,22,24).
What are the key properties of N-(2,6-diethylphenyl)-2-(2-methyl-2,3-dihydroindol-1-yl)acetamide?
N-(2,6-diethylphenyl)-2-(2-methyl-2,3-dihydroindol-1-yl)acetamide has a molecular weight of 322.45 g/mol, XLogP of 4.20, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-diethylphenyl)-2-(2-methyl-2,3-dihydroindol-1-yl)acetamide is sourced from PubChem (CID 22199993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).