2-(4-methylphenyl)-N-[(2-oxo-1,3-dihydroindol-5-yl)methyl]acetamide

C18H18N2O2 — CID 110781350

IUPAC2-(4-methylphenyl)-N-[(2-oxo-1,3-dihydroindol-5-yl)methyl]acetamide
SMILESCc1ccc(CC(=O)NCc2ccc3c(c2)CC(=O)N3)cc1
InChIInChI=1S/C18H18N2O2/c1-12-2-4-13(5-3-12)9-17(21)19-11-14-6-7-16-15(8-14)10-18(22)20-16/h2-8H,9-11H2,1H3,(H,19,21)(H,20,22)
InChIKeyQBTWPIUGNDZICP-UHFFFAOYSA-N
MW294.35 g/mol
LogP2.35
Rot. Bonds4

About 2-(4-methylphenyl)-N-[(2-oxo-1,3-dihydroindol-5-yl)methyl]acetamide

2-(4-methylphenyl)-N-[(2-oxo-1,3-dihydroindol-5-yl)methyl]acetamide (PubChem CID 110781350) has the molecular formula C18H18N2O2 and a molecular weight of 294.35 g/mol. Its IUPAC name is 2-(4-methylphenyl)-N-[(2-oxo-1,3-dihydroindol-5-yl)methyl]acetamide.

Molecular Properties

Compound Name2-(4-methylphenyl)-N-[(2-oxo-1,3-dihydroindol-5-yl)methyl]acetamide
PubChem CID110781350
Molecular FormulaC18H18N2O2
Molecular Weight294.35 g/mol
Exact Mass294.14
IUPAC Name2-(4-methylphenyl)-N-[(2-oxo-1,3-dihydroindol-5-yl)methyl]acetamide
SMILESCc1ccc(CC(=O)NCc2ccc3c(c2)CC(=O)N3)cc1
InChIInChI=1S/C18H18N2O2/c1-12-2-4-13(5-3-12)9-17(21)19-11-14-6-7-16-15(8-14)10-18(22)20-16/h2-8H,9-11H2,1H3,(H,19,21)(H,20,22)
InChIKeyQBTWPIUGNDZICP-UHFFFAOYSA-N
XLogP2.35
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.35
LogP ≤ 52.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-oxo-4-[(2-oxo-1,3-dihydroindol-5-yl)methylamino]butanoic acid
CID 82501019
N-[(2-oxo-1,3-dihydroindol-5-yl)methyl]-2-(propan-2-ylamino)acetamide
CID 115158229
4-(methylamino)-N-[(2-oxo-1,3-dihydroindol-5-yl)methyl]butanamide
CID 115155707
3,4-dimethyl-N-[(2-oxo-1,3-dihydroindol-5-yl)methyl]benzamide
CID 110781303
2-(2-oxo-1,3-dihydroindol-5-yl)-N-prop-2-enylacetamide
CID 110768065
N-[(2-methoxyphenyl)methyl]-2-(2-oxo-1,3-dihydroindol-5-yl)acetamide
CID 110768097
N'-methyl-2-(2-oxo-1,3-dihydroindol-5-yl)acetohydrazide
CID 116846191
2-(2-oxo-1,3-dihydroindol-5-yl)acetamide
CID 82490915
N-[2-(4-fluorophenyl)ethyl]-2-(2-oxo-1,3-dihydroindol-5-yl)acetamide
CID 110768108
N-[(2-oxo-1,3-dihydroindol-5-yl)methyl]cyclohexanecarboxamide
CID 110781277
6-oxo-N-[(2-oxo-1,3-dihydroindol-5-yl)methyl]-4,5-dihydro-1H-pyridazine-3-carboxamide
CID 110793824
3-amino-N-[(2-oxo-1,3-dihydroindol-5-yl)methyl]cyclobutane-1-carboxamide
CID 115161516

Frequently Asked Questions

What is the IUPAC name of 2-(4-methylphenyl)-N-[(2-oxo-1,3-dihydroindol-5-yl)methyl]acetamide?
The IUPAC name of 2-(4-methylphenyl)-N-[(2-oxo-1,3-dihydroindol-5-yl)methyl]acetamide (CID 110781350) is 2-(4-methylphenyl)-N-[(2-oxo-1,3-dihydroindol-5-yl)methyl]acetamide.
What is the SMILES notation for 2-(4-methylphenyl)-N-[(2-oxo-1,3-dihydroindol-5-yl)methyl]acetamide?
The canonical SMILES for 2-(4-methylphenyl)-N-[(2-oxo-1,3-dihydroindol-5-yl)methyl]acetamide is Cc1ccc(CC(=O)NCc2ccc3c(c2)CC(=O)N3)cc1.
What is the InChIKey of 2-(4-methylphenyl)-N-[(2-oxo-1,3-dihydroindol-5-yl)methyl]acetamide?
The InChIKey is QBTWPIUGNDZICP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2O2/c1-12-2-4-13(5-3-12)9-17(21)19-11-14-6-7-16-15(8-14)10-18(22)20-16/h2-8H,9-11H2,1H3,(H,19,21)(H,20,22).
What are the key properties of 2-(4-methylphenyl)-N-[(2-oxo-1,3-dihydroindol-5-yl)methyl]acetamide?
2-(4-methylphenyl)-N-[(2-oxo-1,3-dihydroindol-5-yl)methyl]acetamide has a molecular weight of 294.35 g/mol, XLogP of 2.35, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methylphenyl)-N-[(2-oxo-1,3-dihydroindol-5-yl)methyl]acetamide is sourced from PubChem (CID 110781350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).