N-[1-(3-methylbenzoyl)-2,3-dihydroindol-7-yl]acetamide

C18H18N2O2 — CID 112537232

IUPACN-[1-(3-methylbenzoyl)-2,3-dihydroindol-7-yl]acetamide
SMILESCC(=O)Nc1cccc2c1N(C(=O)c1cccc(C)c1)CC2
InChIInChI=1S/C18H18N2O2/c1-12-5-3-7-15(11-12)18(22)20-10-9-14-6-4-8-16(17(14)20)19-13(2)21/h3-8,11H,9-10H2,1-2H3,(H,19,21)
InChIKeyVCQGUTFURRWGRS-UHFFFAOYSA-N
MW294.35 g/mol
LogP3.16
Rot. Bonds2

About N-[1-(3-methylbenzoyl)-2,3-dihydroindol-7-yl]acetamide

N-[1-(3-methylbenzoyl)-2,3-dihydroindol-7-yl]acetamide (PubChem CID 112537232) has the molecular formula C18H18N2O2 and a molecular weight of 294.35 g/mol. Its IUPAC name is N-[1-(3-methylbenzoyl)-2,3-dihydroindol-7-yl]acetamide.

Molecular Properties

Compound NameN-[1-(3-methylbenzoyl)-2,3-dihydroindol-7-yl]acetamide
PubChem CID112537232
Molecular FormulaC18H18N2O2
Molecular Weight294.35 g/mol
Exact Mass294.14
IUPAC NameN-[1-(3-methylbenzoyl)-2,3-dihydroindol-7-yl]acetamide
SMILESCC(=O)Nc1cccc2c1N(C(=O)c1cccc(C)c1)CC2
InChIInChI=1S/C18H18N2O2/c1-12-5-3-7-15(11-12)18(22)20-10-9-14-6-4-8-16(17(14)20)19-13(2)21/h3-8,11H,9-10H2,1-2H3,(H,19,21)
InChIKeyVCQGUTFURRWGRS-UHFFFAOYSA-N
XLogP3.16
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.35
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[1-[4-(dimethylamino)benzoyl]-2,3-dihydroindol-7-yl]acetamide
CID 112537299
N-(1-acetyl-2,3-dihydroindol-7-yl)-2-methylpropanamide
CID 112537152
N-[3-(2,3-dihydroindole-1-carbonyl)phenyl]acetamide
CID 26290520
N-(1-formyl-2,3-dihydroindol-7-yl)acetamide
CID 112537361
3,4-dihydro-2H-quinolin-1-yl-(3-methylphenyl)methanone
CID 669077
(7-methyl-2,3-dihydroindol-1-yl)-naphthalen-2-ylmethanone
CID 112835715
N-(1-acetyl-2,3-dihydroindol-7-yl)-4-bromobenzamide
CID 112537123
1-(2-ethylphenyl)-3-[[1-(3-methylbenzoyl)-2,3-dihydroindol-6-yl]methyl]urea
CID 53099740
(7-amino-2,3-dihydroindol-1-yl)-(3-hydroxyphenyl)methanone
CID 114455702
1-(1-acetyl-2,3-dihydroindol-7-yl)-3-(2,4-difluorophenyl)urea
CID 3415037
7-benzamido-N-tert-butyl-2,3-dihydroindole-1-carboxamide
CID 132583260
N-(1-acetyl-2,3-dihydroindol-7-yl)-2-(2-methylphenyl)acetamide
CID 112537144

Frequently Asked Questions

What is the IUPAC name of N-[1-(3-methylbenzoyl)-2,3-dihydroindol-7-yl]acetamide?
The IUPAC name of N-[1-(3-methylbenzoyl)-2,3-dihydroindol-7-yl]acetamide (CID 112537232) is N-[1-(3-methylbenzoyl)-2,3-dihydroindol-7-yl]acetamide.
What is the SMILES notation for N-[1-(3-methylbenzoyl)-2,3-dihydroindol-7-yl]acetamide?
The canonical SMILES for N-[1-(3-methylbenzoyl)-2,3-dihydroindol-7-yl]acetamide is CC(=O)Nc1cccc2c1N(C(=O)c1cccc(C)c1)CC2.
What is the InChIKey of N-[1-(3-methylbenzoyl)-2,3-dihydroindol-7-yl]acetamide?
The InChIKey is VCQGUTFURRWGRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2O2/c1-12-5-3-7-15(11-12)18(22)20-10-9-14-6-4-8-16(17(14)20)19-13(2)21/h3-8,11H,9-10H2,1-2H3,(H,19,21).
What are the key properties of N-[1-(3-methylbenzoyl)-2,3-dihydroindol-7-yl]acetamide?
N-[1-(3-methylbenzoyl)-2,3-dihydroindol-7-yl]acetamide has a molecular weight of 294.35 g/mol, XLogP of 3.16, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(3-methylbenzoyl)-2,3-dihydroindol-7-yl]acetamide is sourced from PubChem (CID 112537232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).