5-methoxy-3-(4-methoxyphenyl)-1,1,3-trimethyl-2H-indene

C20H24O2 — CID 624568

IUPAC5-methoxy-3-(4-methoxyphenyl)-1,1,3-trimethyl-2H-indene
SMILESCOc1ccc(C2(C)CC(C)(C)c3ccc(OC)cc32)cc1
InChIInChI=1S/C20H24O2/c1-19(2)13-20(3,14-6-8-15(21-4)9-7-14)18-12-16(22-5)10-11-17(18)19/h6-12H,13H2,1-5H3
InChIKeyRKSZGJIIRCVRRQ-UHFFFAOYSA-N
MW296.41 g/mol
LogP4.69
Rot. Bonds3

About 5-methoxy-3-(4-methoxyphenyl)-1,1,3-trimethyl-2H-indene

5-methoxy-3-(4-methoxyphenyl)-1,1,3-trimethyl-2H-indene (PubChem CID 624568) has the molecular formula C20H24O2 and a molecular weight of 296.41 g/mol. Its IUPAC name is 5-methoxy-3-(4-methoxyphenyl)-1,1,3-trimethyl-2H-indene.

Molecular Properties

Compound Name5-methoxy-3-(4-methoxyphenyl)-1,1,3-trimethyl-2H-indene
PubChem CID624568
Molecular FormulaC20H24O2
Molecular Weight296.41 g/mol
Exact Mass296.18
IUPAC Name5-methoxy-3-(4-methoxyphenyl)-1,1,3-trimethyl-2H-indene
SMILESCOc1ccc(C2(C)CC(C)(C)c3ccc(OC)cc32)cc1
InChIInChI=1S/C20H24O2/c1-19(2)13-20(3,14-6-8-15(21-4)9-7-14)18-12-16(22-5)10-11-17(18)19/h6-12H,13H2,1-5H3
InChIKeyRKSZGJIIRCVRRQ-UHFFFAOYSA-N
XLogP4.69
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.41
LogP ≤ 54.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-methoxy-3-(4-methoxyphenyl)-1,1,3-trimethyl-2H-indene?
The IUPAC name of 5-methoxy-3-(4-methoxyphenyl)-1,1,3-trimethyl-2H-indene (CID 624568) is 5-methoxy-3-(4-methoxyphenyl)-1,1,3-trimethyl-2H-indene.
What is the SMILES notation for 5-methoxy-3-(4-methoxyphenyl)-1,1,3-trimethyl-2H-indene?
The canonical SMILES for 5-methoxy-3-(4-methoxyphenyl)-1,1,3-trimethyl-2H-indene is COc1ccc(C2(C)CC(C)(C)c3ccc(OC)cc32)cc1.
What is the InChIKey of 5-methoxy-3-(4-methoxyphenyl)-1,1,3-trimethyl-2H-indene?
The InChIKey is RKSZGJIIRCVRRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24O2/c1-19(2)13-20(3,14-6-8-15(21-4)9-7-14)18-12-16(22-5)10-11-17(18)19/h6-12H,13H2,1-5H3.
What are the key properties of 5-methoxy-3-(4-methoxyphenyl)-1,1,3-trimethyl-2H-indene?
5-methoxy-3-(4-methoxyphenyl)-1,1,3-trimethyl-2H-indene has a molecular weight of 296.41 g/mol, XLogP of 4.69, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-3-(4-methoxyphenyl)-1,1,3-trimethyl-2H-indene is sourced from PubChem (CID 624568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).