N-(3-methyl-2-oxo-1,3-dihydroindol-5-yl)-2-(3-methylphenoxy)acetamide

C18H18N2O3 — CID 110667031

IUPACN-(3-methyl-2-oxo-1,3-dihydroindol-5-yl)-2-(3-methylphenoxy)acetamide
SMILESCc1cccc(OCC(=O)Nc2ccc3c(c2)C(C)C(=O)N3)c1
InChIInChI=1S/C18H18N2O3/c1-11-4-3-5-14(8-11)23-10-17(21)19-13-6-7-16-15(9-13)12(2)18(22)20-16/h3-9,12H,10H2,1-2H3,(H,19,21)(H,20,22)
InChIKeyXJGSTURRCJOUHD-UHFFFAOYSA-N
MW310.35 g/mol
LogP3.07
Rot. Bonds4

About N-(3-methyl-2-oxo-1,3-dihydroindol-5-yl)-2-(3-methylphenoxy)acetamide

N-(3-methyl-2-oxo-1,3-dihydroindol-5-yl)-2-(3-methylphenoxy)acetamide (PubChem CID 110667031) has the molecular formula C18H18N2O3 and a molecular weight of 310.35 g/mol. Its IUPAC name is N-(3-methyl-2-oxo-1,3-dihydroindol-5-yl)-2-(3-methylphenoxy)acetamide.

Molecular Properties

Compound NameN-(3-methyl-2-oxo-1,3-dihydroindol-5-yl)-2-(3-methylphenoxy)acetamide
PubChem CID110667031
Molecular FormulaC18H18N2O3
Molecular Weight310.35 g/mol
Exact Mass310.13
IUPAC NameN-(3-methyl-2-oxo-1,3-dihydroindol-5-yl)-2-(3-methylphenoxy)acetamide
SMILESCc1cccc(OCC(=O)Nc2ccc3c(c2)C(C)C(=O)N3)c1
InChIInChI=1S/C18H18N2O3/c1-11-4-3-5-14(8-11)23-10-17(21)19-13-6-7-16-15(9-13)12(2)18(22)20-16/h3-9,12H,10H2,1-2H3,(H,19,21)(H,20,22)
InChIKeyXJGSTURRCJOUHD-UHFFFAOYSA-N
XLogP3.07
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.35
LogP ≤ 53.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-methyl-2-oxo-1,3-dihydroindol-5-yl)-4-phenoxybutanamide
CID 110405900
2-(3-methylphenoxy)-N-(3-methylphenyl)acetamide
CID 2787094
N-(2-oxo-3-propan-2-yl-1,3-dihydroindol-5-yl)-2-phenoxyacetamide
CID 110406065
N-[3-(2,5-dioxoimidazolidin-4-yl)phenyl]-2-(3-methylphenoxy)acetamide
CID 110715491
N-[3-[[2-(3-methylphenoxy)acetyl]amino]phenyl]propanamide
CID 883065
N-[3-(aminomethyl)phenyl]-2-(3-methylphenoxy)acetamide
CID 16783753
N-[(2S)-2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl]-3-(3-methylphenoxy)propanamide
CID 9145274
N-(3-aminophenyl)-2-(3-methylphenoxy)acetamide
CID 16789843
2-(3-methylphenoxy)-N-(4-methylsulfanylphenyl)acetamide
CID 9153755
2-(3-methylphenoxy)-N-(2-oxo-3H-1,3-benzoxazol-6-yl)acetamide
CID 110662124
2-(3-methylphenoxy)-N-(3-oxo-1,2-dihydroisoindol-5-yl)acetamide
CID 86872676
N-(3-methyl-2-oxo-1H-quinolin-7-yl)-2-(3-methylphenoxy)acetamide
CID 110668350

Frequently Asked Questions

What is the IUPAC name of N-(3-methyl-2-oxo-1,3-dihydroindol-5-yl)-2-(3-methylphenoxy)acetamide?
The IUPAC name of N-(3-methyl-2-oxo-1,3-dihydroindol-5-yl)-2-(3-methylphenoxy)acetamide (CID 110667031) is N-(3-methyl-2-oxo-1,3-dihydroindol-5-yl)-2-(3-methylphenoxy)acetamide.
What is the SMILES notation for N-(3-methyl-2-oxo-1,3-dihydroindol-5-yl)-2-(3-methylphenoxy)acetamide?
The canonical SMILES for N-(3-methyl-2-oxo-1,3-dihydroindol-5-yl)-2-(3-methylphenoxy)acetamide is Cc1cccc(OCC(=O)Nc2ccc3c(c2)C(C)C(=O)N3)c1.
What is the InChIKey of N-(3-methyl-2-oxo-1,3-dihydroindol-5-yl)-2-(3-methylphenoxy)acetamide?
The InChIKey is XJGSTURRCJOUHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2O3/c1-11-4-3-5-14(8-11)23-10-17(21)19-13-6-7-16-15(9-13)12(2)18(22)20-16/h3-9,12H,10H2,1-2H3,(H,19,21)(H,20,22).
What are the key properties of N-(3-methyl-2-oxo-1,3-dihydroindol-5-yl)-2-(3-methylphenoxy)acetamide?
N-(3-methyl-2-oxo-1,3-dihydroindol-5-yl)-2-(3-methylphenoxy)acetamide has a molecular weight of 310.35 g/mol, XLogP of 3.07, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methyl-2-oxo-1,3-dihydroindol-5-yl)-2-(3-methylphenoxy)acetamide is sourced from PubChem (CID 110667031), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).