indol-1-yl-(2-methoxyphenyl)methanone

C16H13NO2 — CID 39846486

IUPACindol-1-yl-(2-methoxyphenyl)methanone
SMILESCOc1ccccc1C(=O)n1ccc2ccccc21
InChIInChI=1S/C16H13NO2/c1-19-15-9-5-3-7-13(15)16(18)17-11-10-12-6-2-4-8-14(12)17/h2-11H,1H3
InChIKeyRKTYBQWUQTWRIO-UHFFFAOYSA-N
MW251.29 g/mol
LogP3.34
Rot. Bonds2

About indol-1-yl-(2-methoxyphenyl)methanone

indol-1-yl-(2-methoxyphenyl)methanone (PubChem CID 39846486) has the molecular formula C16H13NO2 and a molecular weight of 251.29 g/mol. Its IUPAC name is indol-1-yl-(2-methoxyphenyl)methanone.

Molecular Properties

Compound Nameindol-1-yl-(2-methoxyphenyl)methanone
PubChem CID39846486
Molecular FormulaC16H13NO2
Molecular Weight251.29 g/mol
Exact Mass251.09
IUPAC Nameindol-1-yl-(2-methoxyphenyl)methanone
SMILESCOc1ccccc1C(=O)n1ccc2ccccc21
InChIInChI=1S/C16H13NO2/c1-19-15-9-5-3-7-13(15)16(18)17-11-10-12-6-2-4-8-14(12)17/h2-11H,1H3
InChIKeyRKTYBQWUQTWRIO-UHFFFAOYSA-N
XLogP3.34
TPSA31.23 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.29
LogP ≤ 53.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-methoxybenzoyl)indole-3-carboxamide
CID 91690536
1-indol-1-ylethanone;hydrochloride
CID 21333501
(2-ethylimidazol-1-yl)-(2-methoxyphenyl)methanone
CID 110463081
2-indol-1-yl-N-[(E)-1-(2-methoxyphenyl)ethylideneamino]acetamide
CID 7316808
fluoro indole-1-carboxylate
CID 129249849
1-indol-1-yl-2-methylpropan-1-one
CID 12637473
1,3-bis(2-methoxyphenyl)propane-1,3-dione
CID 15664665
2-methoxybenzoyl iodide
CID 139677083
CID 135043978
CID 135043978
2-indazol-1-yl-1-(2-methoxyphenyl)ethanone
CID 62140573
(2-cyclohexylimino-4-methyl-1-pyridinyl)-(2-methoxyphenyl)methanone
CID 46517992
[(3R)-3-hydroxypyrrolidin-1-yl]-(2-methoxyphenyl)methanone
CID 10560934

Frequently Asked Questions

What is the IUPAC name of indol-1-yl-(2-methoxyphenyl)methanone?
The IUPAC name of indol-1-yl-(2-methoxyphenyl)methanone (CID 39846486) is indol-1-yl-(2-methoxyphenyl)methanone.
What is the SMILES notation for indol-1-yl-(2-methoxyphenyl)methanone?
The canonical SMILES for indol-1-yl-(2-methoxyphenyl)methanone is COc1ccccc1C(=O)n1ccc2ccccc21.
What is the InChIKey of indol-1-yl-(2-methoxyphenyl)methanone?
The InChIKey is RKTYBQWUQTWRIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13NO2/c1-19-15-9-5-3-7-13(15)16(18)17-11-10-12-6-2-4-8-14(12)17/h2-11H,1H3.
What are the key properties of indol-1-yl-(2-methoxyphenyl)methanone?
indol-1-yl-(2-methoxyphenyl)methanone has a molecular weight of 251.29 g/mol, XLogP of 3.34, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for indol-1-yl-(2-methoxyphenyl)methanone is sourced from PubChem (CID 39846486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).