[3-(2,6-dimethoxyphenyl)-1H-inden-1-yl]methanol

C18H18O3 — CID 132518631

IUPAC[3-(2,6-dimethoxyphenyl)-1H-inden-1-yl]methanol
SMILESCOc1cccc(OC)c1C1=CC(CO)c2ccccc21
InChIInChI=1S/C18H18O3/c1-20-16-8-5-9-17(21-2)18(16)15-10-12(11-19)13-6-3-4-7-14(13)15/h3-10,12,19H,11H2,1-2H3
InChIKeyYQCGLWWBYIKCPE-UHFFFAOYSA-N
MW282.34 g/mol
LogP3.22
Rot. Bonds4

About [3-(2,6-dimethoxyphenyl)-1H-inden-1-yl]methanol

[3-(2,6-dimethoxyphenyl)-1H-inden-1-yl]methanol (PubChem CID 132518631) has the molecular formula C18H18O3 and a molecular weight of 282.34 g/mol. Its IUPAC name is [3-(2,6-dimethoxyphenyl)-1H-inden-1-yl]methanol.

Molecular Properties

Compound Name[3-(2,6-dimethoxyphenyl)-1H-inden-1-yl]methanol
PubChem CID132518631
Molecular FormulaC18H18O3
Molecular Weight282.34 g/mol
Exact Mass282.13
IUPAC Name[3-(2,6-dimethoxyphenyl)-1H-inden-1-yl]methanol
SMILESCOc1cccc(OC)c1C1=CC(CO)c2ccccc21
InChIInChI=1S/C18H18O3/c1-20-16-8-5-9-17(21-2)18(16)15-10-12(11-19)13-6-3-4-7-14(13)15/h3-10,12,19H,11H2,1-2H3
InChIKeyYQCGLWWBYIKCPE-UHFFFAOYSA-N
XLogP3.22
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.34
LogP ≤ 53.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(2,3,4-trimethoxy-1H-inden-1-yl)propan-1-ol
CID 157385865
[6-(2-methoxyphenyl)-2-pyridinyl]methanol
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1-methoxy-2-[4-[4-(2-methoxyphenyl)phenyl]phenyl]benzene
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[2-(2-methoxyphenyl)-1,2-dihydropyridin-4-yl]methanol
CID 142201396
9-(2-methoxyphenyl)-9H-fluorene
CID 10492416
2-[2-(hydroxymethyl)phenyl]-3-methoxybenzoyl chloride
CID 10062032
2-[2-amino-3-(2,6-dimethoxyphenyl)phenyl]ethanol
CID 154291295
2,3,4-trimethoxy-1-[5-(2,3,4-trimethoxy-1H-inden-1-yl)pentyl]-1H-indene
CID 151740350
3-methoxy-2-(2-methylphenyl)phenol
CID 122691974
1-[3-methoxy-2-(2-methoxyphenyl)phenyl]propan-2-one
CID 56654613
(3R)-3-hydroxy-7-methoxy-2-methyl-3H-isoindol-1-one
CID 820535
2-bromo-1,3-bis(2,6-dimethoxyphenyl)benzene
CID 51042386

Frequently Asked Questions

What is the IUPAC name of [3-(2,6-dimethoxyphenyl)-1H-inden-1-yl]methanol?
The IUPAC name of [3-(2,6-dimethoxyphenyl)-1H-inden-1-yl]methanol (CID 132518631) is [3-(2,6-dimethoxyphenyl)-1H-inden-1-yl]methanol.
What is the SMILES notation for [3-(2,6-dimethoxyphenyl)-1H-inden-1-yl]methanol?
The canonical SMILES for [3-(2,6-dimethoxyphenyl)-1H-inden-1-yl]methanol is COc1cccc(OC)c1C1=CC(CO)c2ccccc21.
What is the InChIKey of [3-(2,6-dimethoxyphenyl)-1H-inden-1-yl]methanol?
The InChIKey is YQCGLWWBYIKCPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18O3/c1-20-16-8-5-9-17(21-2)18(16)15-10-12(11-19)13-6-3-4-7-14(13)15/h3-10,12,19H,11H2,1-2H3.
What are the key properties of [3-(2,6-dimethoxyphenyl)-1H-inden-1-yl]methanol?
[3-(2,6-dimethoxyphenyl)-1H-inden-1-yl]methanol has a molecular weight of 282.34 g/mol, XLogP of 3.22, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(2,6-dimethoxyphenyl)-1H-inden-1-yl]methanol is sourced from PubChem (CID 132518631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).