4-(4-methoxyphenyl)-2,6-dimethyl-1H-indene

C18H18O — CID 173192637

IUPAC4-(4-methoxyphenyl)-2,6-dimethyl-1H-indene
SMILESCOc1ccc(-c2cc(C)cc3c2C=C(C)C3)cc1
InChIInChI=1S/C18H18O/c1-12-8-15-9-13(2)11-18(15)17(10-12)14-4-6-16(19-3)7-5-14/h4-8,10-11H,9H2,1-3H3
InChIKeyQMHTYBQFBGVNDL-UHFFFAOYSA-N
MW250.34 g/mol
LogP4.63
Rot. Bonds2

About 4-(4-methoxyphenyl)-2,6-dimethyl-1H-indene

4-(4-methoxyphenyl)-2,6-dimethyl-1H-indene (PubChem CID 173192637) has the molecular formula C18H18O and a molecular weight of 250.34 g/mol. Its IUPAC name is 4-(4-methoxyphenyl)-2,6-dimethyl-1H-indene.

Molecular Properties

Compound Name4-(4-methoxyphenyl)-2,6-dimethyl-1H-indene
PubChem CID173192637
Molecular FormulaC18H18O
Molecular Weight250.34 g/mol
Exact Mass250.14
IUPAC Name4-(4-methoxyphenyl)-2,6-dimethyl-1H-indene
SMILESCOc1ccc(-c2cc(C)cc3c2C=C(C)C3)cc1
InChIInChI=1S/C18H18O/c1-12-8-15-9-13(2)11-18(15)17(10-12)14-4-6-16(19-3)7-5-14/h4-8,10-11H,9H2,1-3H3
InChIKeyQMHTYBQFBGVNDL-UHFFFAOYSA-N
XLogP4.63
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.34
LogP ≤ 54.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2,6-dimethyl-4-(4-propylphenyl)-1H-indene
CID 87521295
4-(3,5-dimethoxyphenyl)-2-methyl-1H-indene
CID 173192850
2-tert-butyl-4-(4-methoxyphenyl)-1H-indene
CID 87961320
bis[2-[4-(4-methoxyphenyl)phenyl]-4-methyl-6-(4-phenylphenyl)phenyl]diazene
CID 102573103
5-methoxy-2-methyl-1H-indene
CID 12616525
trimethyl-(2-methyl-7-phenyl-3H-inden-5-yl)azanium
CID 173242398
1-(4-methoxyphenyl)-5-(4-methylphenyl)naphthalene
CID 142669243
1-(113C)methoxy-4-methylbenzene
CID 166176950
2,7-bis(4-methoxyphenyl)-9H-fluorene
CID 67050058
1-cyclopropyl-2-(4-methoxyphenyl)-4-methylbenzene
CID 141433382
5,18-bis(4-methoxyphenyl)-7,16-dimethyl-3,10,13,20-tetrazapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(20),2,4,6,8,14,16,18-octaene
CID 139190140
methane;1-methoxy-4-(4-methylphenyl)benzene
CID 159881054

Frequently Asked Questions

What is the IUPAC name of 4-(4-methoxyphenyl)-2,6-dimethyl-1H-indene?
The IUPAC name of 4-(4-methoxyphenyl)-2,6-dimethyl-1H-indene (CID 173192637) is 4-(4-methoxyphenyl)-2,6-dimethyl-1H-indene.
What is the SMILES notation for 4-(4-methoxyphenyl)-2,6-dimethyl-1H-indene?
The canonical SMILES for 4-(4-methoxyphenyl)-2,6-dimethyl-1H-indene is COc1ccc(-c2cc(C)cc3c2C=C(C)C3)cc1.
What is the InChIKey of 4-(4-methoxyphenyl)-2,6-dimethyl-1H-indene?
The InChIKey is QMHTYBQFBGVNDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18O/c1-12-8-15-9-13(2)11-18(15)17(10-12)14-4-6-16(19-3)7-5-14/h4-8,10-11H,9H2,1-3H3.
What are the key properties of 4-(4-methoxyphenyl)-2,6-dimethyl-1H-indene?
4-(4-methoxyphenyl)-2,6-dimethyl-1H-indene has a molecular weight of 250.34 g/mol, XLogP of 4.63, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-methoxyphenyl)-2,6-dimethyl-1H-indene is sourced from PubChem (CID 173192637), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).