1-(2-methylphenoxy)-2,3-dihydro-1H-indene

C16H16O — CID 57123599

IUPAC1-(2-methylphenoxy)-2,3-dihydro-1H-indene
SMILESCc1ccccc1OC1CCc2ccccc21
InChIInChI=1S/C16H16O/c1-12-6-2-5-9-15(12)17-16-11-10-13-7-3-4-8-14(13)16/h2-9,16H,10-11H2,1H3
InChIKeyQAVFFOCTDKGHLH-UHFFFAOYSA-N
MW224.30 g/mol
LogP4.06
Rot. Bonds2

About 1-(2-methylphenoxy)-2,3-dihydro-1H-indene

1-(2-methylphenoxy)-2,3-dihydro-1H-indene (PubChem CID 57123599) has the molecular formula C16H16O and a molecular weight of 224.30 g/mol. Its IUPAC name is 1-(2-methylphenoxy)-2,3-dihydro-1H-indene.

Molecular Properties

Compound Name1-(2-methylphenoxy)-2,3-dihydro-1H-indene
PubChem CID57123599
Molecular FormulaC16H16O
Molecular Weight224.30 g/mol
Exact Mass224.12
IUPAC Name1-(2-methylphenoxy)-2,3-dihydro-1H-indene
SMILESCc1ccccc1OC1CCc2ccccc21
InChIInChI=1S/C16H16O/c1-12-6-2-5-9-15(12)17-16-11-10-13-7-3-4-8-14(13)16/h2-9,16H,10-11H2,1H3
InChIKeyQAVFFOCTDKGHLH-UHFFFAOYSA-N
XLogP4.06
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.30
LogP ≤ 54.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

(2S,4R)-N-methyl-4-(2-methylphenoxy)-1,2,3,4-tetrahydronaphthalen-2-amine
CID 24969453
(1R,2R)-2-methyl-1-(2-methylphenoxy)-3,4-dihydro-1H-naphthalen-2-ol
CID 71100005
(1R)-1-[2-(1,2,3,4-tetrahydronaphthalen-1-yloxy)phenyl]ethanamine
CID 78937787
1-(2,3-dihydro-1H-inden-1-yloxymethoxy)-2,3-dihydro-1H-indene
CID 70037925
2-(2,3-dihydro-1H-inden-1-yloxy)-3-methoxybenzonitrile
CID 117052936
[8-(2,3-dihydro-1H-inden-1-yloxy)-2-methylimidazo[1,2-a]pyridin-3-yl]methanol
CID 70404568
2-(2-methylphenoxy)cyclohexan-1-one
CID 22748321
3-(2-fluoro-3-methylphenoxy)-1,3,4,5-tetrahydro-1-benzazepin-2-one
CID 107661976
5-[[(1S)-2,3-dihydro-1H-inden-1-yl]oxy]quinazoline-2,4-diamine
CID 66924142
2-fluoro-6-(1,2,3,4-tetrahydronaphthalen-1-yloxy)aniline
CID 60790202
2,3-dihydro-1H-inden-1-yl 2,2-dimethylpropanoate
CID 10262840
ethyl 3-[4-(2,3-dihydro-1H-inden-1-yloxy)-3-fluorophenyl]propanoate
CID 23136317

Frequently Asked Questions

What is the IUPAC name of 1-(2-methylphenoxy)-2,3-dihydro-1H-indene?
The IUPAC name of 1-(2-methylphenoxy)-2,3-dihydro-1H-indene (CID 57123599) is 1-(2-methylphenoxy)-2,3-dihydro-1H-indene.
What is the SMILES notation for 1-(2-methylphenoxy)-2,3-dihydro-1H-indene?
The canonical SMILES for 1-(2-methylphenoxy)-2,3-dihydro-1H-indene is Cc1ccccc1OC1CCc2ccccc21.
What is the InChIKey of 1-(2-methylphenoxy)-2,3-dihydro-1H-indene?
The InChIKey is QAVFFOCTDKGHLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16O/c1-12-6-2-5-9-15(12)17-16-11-10-13-7-3-4-8-14(13)16/h2-9,16H,10-11H2,1H3.
What are the key properties of 1-(2-methylphenoxy)-2,3-dihydro-1H-indene?
1-(2-methylphenoxy)-2,3-dihydro-1H-indene has a molecular weight of 224.30 g/mol, XLogP of 4.06, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methylphenoxy)-2,3-dihydro-1H-indene is sourced from PubChem (CID 57123599), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).