5-(3-Methoxy-phenyl)-3,3-dimethyl-1,3-dihydro-indol-2-one

HCID 9860141
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Basic information

Standard SMILES
COc1cccc(-c2ccc3c(c2)C(C)(C)C(=O)N3)c1
InChIKey
OWQAYYLCRJWAKR-UHFFFAOYSA-N
Molecular formula
C17H17NO2
Average molar mass
267.32 g/mol

Names & identifiers

Preferred name
5-(3-Methoxy-phenyl)-3,3-dimethyl-1,3-dihydro-indol-2-one
IUPAC
5-(3-methoxyphenyl)-3,3-dimethyl-1H-indol-2-one

Names & synonyms

CHEMBL1180425-(3-Methoxy-phenyl)-3,3-dimethyl-1,3-dihydro-indol-2-oneSCHEMBL5225707OWQAYYLCRJWAKR-UHFFFAOYSA-NBDBM50121155

Database identifiers

PubChem CID
9860141
ChEMBL
CHEMBL118042
Nikkaji
J1.826.859K

Properties

Computed structural properties

XLogP
3.3
Topological polar surface area
38.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
2
Heavy atoms
20

Related reactions

7 records
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Compound notes

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