1,1,3-trimethyl-3-(4-methylphenyl)-2H-inden-5-ol

C19H22O — CID 59962334

IUPAC1,1,3-trimethyl-3-(4-methylphenyl)-2H-inden-5-ol
SMILESCc1ccc(C2(C)CC(C)(C)c3ccc(O)cc32)cc1
InChIInChI=1S/C19H22O/c1-13-5-7-14(8-6-13)19(4)12-18(2,3)16-10-9-15(20)11-17(16)19/h5-11,20H,12H2,1-4H3
InChIKeyFXSVWQWWEOGMNY-UHFFFAOYSA-N
MW266.38 g/mol
LogP4.69
Rot. Bonds1

About 1,1,3-trimethyl-3-(4-methylphenyl)-2H-inden-5-ol

1,1,3-trimethyl-3-(4-methylphenyl)-2H-inden-5-ol (PubChem CID 59962334) has the molecular formula C19H22O and a molecular weight of 266.38 g/mol. Its IUPAC name is 1,1,3-trimethyl-3-(4-methylphenyl)-2H-inden-5-ol.

Molecular Properties

Compound Name1,1,3-trimethyl-3-(4-methylphenyl)-2H-inden-5-ol
PubChem CID59962334
Molecular FormulaC19H22O
Molecular Weight266.38 g/mol
Exact Mass266.17
IUPAC Name1,1,3-trimethyl-3-(4-methylphenyl)-2H-inden-5-ol
SMILESCc1ccc(C2(C)CC(C)(C)c3ccc(O)cc32)cc1
InChIInChI=1S/C19H22O/c1-13-5-7-14(8-6-13)19(4)12-18(2,3)16-10-9-15(20)11-17(16)19/h5-11,20H,12H2,1-4H3
InChIKeyFXSVWQWWEOGMNY-UHFFFAOYSA-N
XLogP4.69
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.38
LogP ≤ 54.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1,1,3-trimethyl-3-(4-methylphenyl)-2H-inden-5-ol?
The IUPAC name of 1,1,3-trimethyl-3-(4-methylphenyl)-2H-inden-5-ol (CID 59962334) is 1,1,3-trimethyl-3-(4-methylphenyl)-2H-inden-5-ol.
What is the SMILES notation for 1,1,3-trimethyl-3-(4-methylphenyl)-2H-inden-5-ol?
The canonical SMILES for 1,1,3-trimethyl-3-(4-methylphenyl)-2H-inden-5-ol is Cc1ccc(C2(C)CC(C)(C)c3ccc(O)cc32)cc1.
What is the InChIKey of 1,1,3-trimethyl-3-(4-methylphenyl)-2H-inden-5-ol?
The InChIKey is FXSVWQWWEOGMNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22O/c1-13-5-7-14(8-6-13)19(4)12-18(2,3)16-10-9-15(20)11-17(16)19/h5-11,20H,12H2,1-4H3.
What are the key properties of 1,1,3-trimethyl-3-(4-methylphenyl)-2H-inden-5-ol?
1,1,3-trimethyl-3-(4-methylphenyl)-2H-inden-5-ol has a molecular weight of 266.38 g/mol, XLogP of 4.69, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,3-trimethyl-3-(4-methylphenyl)-2H-inden-5-ol is sourced from PubChem (CID 59962334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).