4-methoxy-1-phenyl-3H-indol-2-one

C15H13NO2 — CID 12777165

IUPAC4-methoxy-1-phenyl-3H-indol-2-one
SMILESCOc1cccc2c1CC(=O)N2c1ccccc1
InChIInChI=1S/C15H13NO2/c1-18-14-9-5-8-13-12(14)10-15(17)16(13)11-6-3-2-4-7-11/h2-9H,10H2,1H3
InChIKeyMFWIJQCKFVBQCB-UHFFFAOYSA-N
MW239.27 g/mol
LogP2.92
Rot. Bonds2

About 4-methoxy-1-phenyl-3H-indol-2-one

4-methoxy-1-phenyl-3H-indol-2-one (PubChem CID 12777165) has the molecular formula C15H13NO2 and a molecular weight of 239.27 g/mol. Its IUPAC name is 4-methoxy-1-phenyl-3H-indol-2-one.

Molecular Properties

Compound Name4-methoxy-1-phenyl-3H-indol-2-one
PubChem CID12777165
Molecular FormulaC15H13NO2
Molecular Weight239.27 g/mol
Exact Mass239.09
IUPAC Name4-methoxy-1-phenyl-3H-indol-2-one
SMILESCOc1cccc2c1CC(=O)N2c1ccccc1
InChIInChI=1S/C15H13NO2/c1-18-14-9-5-8-13-12(14)10-15(17)16(13)11-6-3-2-4-7-11/h2-9H,10H2,1H3
InChIKeyMFWIJQCKFVBQCB-UHFFFAOYSA-N
XLogP2.92
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.27
LogP ≤ 52.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-methoxy-1-methyl-3H-indol-2-one
CID 12713031
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CID 2049348
5-methylphosphanyl-1-phenyl-1,5-benzodiazepine-2,4-dione
CID 155069590
4-(benzylamino)-1-phenyl-3H-indol-2-one
CID 102082479
1,5-diphenyl-1,5-diazocane-2,4,6,8-tetrone
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1-(2-methoxyphenyl)-1,3-diazinane-2,4,6-trione
CID 1380841
1-phenyl-5H-1-benzazepine-2,4-dione
CID 67618146
1-(2-methoxyphenyl)-4-phenylpiperidine-2,6-dione
CID 42628281
3-methylidene-1-phenylpyrrolidine-2,5-dione
CID 13108227
8-methoxy-3,4-dihydro-1H-naphthalen-2-one
CID 4136021
6-bromo-1-(3,5-difluorophenyl)-4-methoxy-3H-indol-2-one
CID 158342619
3-[4-(2-methoxyphenyl)-2,6-dioxopiperazin-1-yl]propanoic acid
CID 82346597

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-1-phenyl-3H-indol-2-one?
The IUPAC name of 4-methoxy-1-phenyl-3H-indol-2-one (CID 12777165) is 4-methoxy-1-phenyl-3H-indol-2-one.
What is the SMILES notation for 4-methoxy-1-phenyl-3H-indol-2-one?
The canonical SMILES for 4-methoxy-1-phenyl-3H-indol-2-one is COc1cccc2c1CC(=O)N2c1ccccc1.
What is the InChIKey of 4-methoxy-1-phenyl-3H-indol-2-one?
The InChIKey is MFWIJQCKFVBQCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13NO2/c1-18-14-9-5-8-13-12(14)10-15(17)16(13)11-6-3-2-4-7-11/h2-9H,10H2,1H3.
What are the key properties of 4-methoxy-1-phenyl-3H-indol-2-one?
4-methoxy-1-phenyl-3H-indol-2-one has a molecular weight of 239.27 g/mol, XLogP of 2.92, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-1-phenyl-3H-indol-2-one is sourced from PubChem (CID 12777165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).