N-(1-acetyl-2,3-dihydroindol-7-yl)-2-(2-methylphenyl)acetamide

C19H20N2O2 — CID 112537144

IUPACN-(1-acetyl-2,3-dihydroindol-7-yl)-2-(2-methylphenyl)acetamide
SMILESCC(=O)N1CCc2cccc(NC(=O)Cc3ccccc3C)c21
InChIInChI=1S/C19H20N2O2/c1-13-6-3-4-7-16(13)12-18(23)20-17-9-5-8-15-10-11-21(14(2)22)19(15)17/h3-9H,10-12H2,1-2H3,(H,20,23)
InChIKeyZRUROPQRPXLVBU-UHFFFAOYSA-N
MW308.38 g/mol
LogP3.09
Rot. Bonds3

About N-(1-acetyl-2,3-dihydroindol-7-yl)-2-(2-methylphenyl)acetamide

N-(1-acetyl-2,3-dihydroindol-7-yl)-2-(2-methylphenyl)acetamide (PubChem CID 112537144) has the molecular formula C19H20N2O2 and a molecular weight of 308.38 g/mol. Its IUPAC name is N-(1-acetyl-2,3-dihydroindol-7-yl)-2-(2-methylphenyl)acetamide.

Molecular Properties

Compound NameN-(1-acetyl-2,3-dihydroindol-7-yl)-2-(2-methylphenyl)acetamide
PubChem CID112537144
Molecular FormulaC19H20N2O2
Molecular Weight308.38 g/mol
Exact Mass308.15
IUPAC NameN-(1-acetyl-2,3-dihydroindol-7-yl)-2-(2-methylphenyl)acetamide
SMILESCC(=O)N1CCc2cccc(NC(=O)Cc3ccccc3C)c21
InChIInChI=1S/C19H20N2O2/c1-13-6-3-4-7-16(13)12-18(23)20-17-9-5-8-15-10-11-21(14(2)22)19(15)17/h3-9H,10-12H2,1-2H3,(H,20,23)
InChIKeyZRUROPQRPXLVBU-UHFFFAOYSA-N
XLogP3.09
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.38
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(1-acetyl-5-bromo-2,3-dihydroindol-7-yl)-2-(2-methylphenyl)acetamide
CID 112536363
N-(1-acetyl-2,3-dihydroindol-7-yl)-2-methylpropanamide
CID 112537152
N-(1-acetyl-2,3-dihydroindol-7-yl)-2-(3-methoxyphenyl)acetamide
CID 112537141
2-(2-methylphenyl)-N-[2-[[2-(2-methylphenyl)acetyl]amino]phenyl]acetamide
CID 26164464
N-(1-acetyl-2,3-dihydroindol-7-yl)-3-pyridin-4-ylpropanamide
CID 112537187
N-(1-acetyl-2,3-dihydroindol-7-yl)-3-morpholin-4-ylpropanamide
CID 112537116
1-(7-ethyl-2,3-dihydroindol-1-yl)ethanone
CID 101108036
N-(1-acetyl-2,3-dihydroindol-7-yl)-4-bromobenzamide
CID 112537123
N-(3-acetamido-2-methylphenyl)-2-(2-methylphenyl)acetamide
CID 39975983
N-(1-acetyl-2,3-dihydroindol-7-yl)-3-(4-methoxyphenyl)propanamide
CID 112537172
1-(1-acetyl-2,3-dihydroindol-7-yl)-3-(2,4-difluorophenyl)urea
CID 3415037
N-(1-acetyl-2,3-dihydroindol-7-yl)-3-(1,3-benzodioxol-5-yl)propanamide
CID 112537184

Frequently Asked Questions

What is the IUPAC name of N-(1-acetyl-2,3-dihydroindol-7-yl)-2-(2-methylphenyl)acetamide?
The IUPAC name of N-(1-acetyl-2,3-dihydroindol-7-yl)-2-(2-methylphenyl)acetamide (CID 112537144) is N-(1-acetyl-2,3-dihydroindol-7-yl)-2-(2-methylphenyl)acetamide.
What is the SMILES notation for N-(1-acetyl-2,3-dihydroindol-7-yl)-2-(2-methylphenyl)acetamide?
The canonical SMILES for N-(1-acetyl-2,3-dihydroindol-7-yl)-2-(2-methylphenyl)acetamide is CC(=O)N1CCc2cccc(NC(=O)Cc3ccccc3C)c21.
What is the InChIKey of N-(1-acetyl-2,3-dihydroindol-7-yl)-2-(2-methylphenyl)acetamide?
The InChIKey is ZRUROPQRPXLVBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O2/c1-13-6-3-4-7-16(13)12-18(23)20-17-9-5-8-15-10-11-21(14(2)22)19(15)17/h3-9H,10-12H2,1-2H3,(H,20,23).
What are the key properties of N-(1-acetyl-2,3-dihydroindol-7-yl)-2-(2-methylphenyl)acetamide?
N-(1-acetyl-2,3-dihydroindol-7-yl)-2-(2-methylphenyl)acetamide has a molecular weight of 308.38 g/mol, XLogP of 3.09, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-acetyl-2,3-dihydroindol-7-yl)-2-(2-methylphenyl)acetamide is sourced from PubChem (CID 112537144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).