N-methyl-3-oxo-N-phenyl-1,2-dihydroindene-2-carboxamide

C17H15NO2 — CID 156571335

IUPACN-methyl-3-oxo-N-phenyl-1,2-dihydroindene-2-carboxamide
SMILESCN(C(=O)C1Cc2ccccc2C1=O)c1ccccc1
InChIInChI=1S/C17H15NO2/c1-18(13-8-3-2-4-9-13)17(20)15-11-12-7-5-6-10-14(12)16(15)19/h2-10,15H,11H2,1H3
InChIKeyRTEMYKDEBDEFLM-UHFFFAOYSA-N
MW265.31 g/mol
LogP2.70
Rot. Bonds2

About N-methyl-3-oxo-N-phenyl-1,2-dihydroindene-2-carboxamide

N-methyl-3-oxo-N-phenyl-1,2-dihydroindene-2-carboxamide (PubChem CID 156571335) has the molecular formula C17H15NO2 and a molecular weight of 265.31 g/mol. Its IUPAC name is N-methyl-3-oxo-N-phenyl-1,2-dihydroindene-2-carboxamide.

Molecular Properties

Compound NameN-methyl-3-oxo-N-phenyl-1,2-dihydroindene-2-carboxamide
PubChem CID156571335
Molecular FormulaC17H15NO2
Molecular Weight265.31 g/mol
Exact Mass265.11
IUPAC NameN-methyl-3-oxo-N-phenyl-1,2-dihydroindene-2-carboxamide
SMILESCN(C(=O)C1Cc2ccccc2C1=O)c1ccccc1
InChIInChI=1S/C17H15NO2/c1-18(13-8-3-2-4-9-13)17(20)15-11-12-7-5-6-10-14(12)16(15)19/h2-10,15H,11H2,1H3
InChIKeyRTEMYKDEBDEFLM-UHFFFAOYSA-N
XLogP2.70
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.31
LogP ≤ 52.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-methyl-3-oxo-N-phenyl-1,2-dihydroindene-2-carboxamide?
The IUPAC name of N-methyl-3-oxo-N-phenyl-1,2-dihydroindene-2-carboxamide (CID 156571335) is N-methyl-3-oxo-N-phenyl-1,2-dihydroindene-2-carboxamide.
What is the SMILES notation for N-methyl-3-oxo-N-phenyl-1,2-dihydroindene-2-carboxamide?
The canonical SMILES for N-methyl-3-oxo-N-phenyl-1,2-dihydroindene-2-carboxamide is CN(C(=O)C1Cc2ccccc2C1=O)c1ccccc1.
What is the InChIKey of N-methyl-3-oxo-N-phenyl-1,2-dihydroindene-2-carboxamide?
The InChIKey is RTEMYKDEBDEFLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15NO2/c1-18(13-8-3-2-4-9-13)17(20)15-11-12-7-5-6-10-14(12)16(15)19/h2-10,15H,11H2,1H3.
What are the key properties of N-methyl-3-oxo-N-phenyl-1,2-dihydroindene-2-carboxamide?
N-methyl-3-oxo-N-phenyl-1,2-dihydroindene-2-carboxamide has a molecular weight of 265.31 g/mol, XLogP of 2.70, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-3-oxo-N-phenyl-1,2-dihydroindene-2-carboxamide is sourced from PubChem (CID 156571335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).