2-(2,3-dimethylphenyl)-1-methyl-1H-indene

C18H18 — CID 21095571

IUPAC2-(2,3-dimethylphenyl)-1-methyl-1H-indene
SMILESCc1cccc(C2=Cc3ccccc3C2C)c1C
InChIInChI=1S/C18H18/c1-12-7-6-10-17(13(12)2)18-11-15-8-4-5-9-16(15)14(18)3/h4-11,14H,1-3H3
InChIKeyNDKGYGKCCDKXOF-UHFFFAOYSA-N
MW234.34 g/mol
LogP4.96
Rot. Bonds1

About 2-(2,3-dimethylphenyl)-1-methyl-1H-indene

2-(2,3-dimethylphenyl)-1-methyl-1H-indene (PubChem CID 21095571) has the molecular formula C18H18 and a molecular weight of 234.34 g/mol. Its IUPAC name is 2-(2,3-dimethylphenyl)-1-methyl-1H-indene.

Molecular Properties

Compound Name2-(2,3-dimethylphenyl)-1-methyl-1H-indene
PubChem CID21095571
Molecular FormulaC18H18
Molecular Weight234.34 g/mol
Exact Mass234.14
IUPAC Name2-(2,3-dimethylphenyl)-1-methyl-1H-indene
SMILESCc1cccc(C2=Cc3ccccc3C2C)c1C
InChIInChI=1S/C18H18/c1-12-7-6-10-17(13(12)2)18-11-15-8-4-5-9-16(15)14(18)3/h4-11,14H,1-3H3
InChIKeyNDKGYGKCCDKXOF-UHFFFAOYSA-N
XLogP4.96
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 54.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'stilbene', 'substructure': 'N/A'}

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Related Compounds

1-methyl-2-(2,3,4-trimethylphenyl)-1H-indene
CID 21095645
1-methyl-2-(2-methylphenyl)-1H-indene
CID 140997796
2-(2,3-dimethylphenyl)-1H-phenalen-1-amine
CID 175022642
1,7-dimethyl-2-(2-propylphenyl)-1H-indene
CID 91805526
1,9-dimethyl-9H-fluorene
CID 28227
2-(3,5-ditert-butylphenyl)-1-methyl-1H-indene
CID 18406157
4,5,9-trimethyl-9H-fluorene
CID 20673052
1-[2-(2,4-dimethyl-4H-cyclopenta[b]naphthalen-1-yl)propan-2-yl]-2,4-dimethyl-4H-cyclopenta[b]naphthalene
CID 90755203
2,4,6-tris(2,3-dimethylphenyl)-1,3,5-triazine
CID 22475994
2-(1-methyl-1H-inden-2-yl)-1-benzofuran
CID 21095546
1,1'-biphenyl;1,2-dimethyl-3-phenylbenzene
CID 173440409
1,2-dimethyl-3-phenylbenzene;ethane
CID 90738674

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dimethylphenyl)-1-methyl-1H-indene?
The IUPAC name of 2-(2,3-dimethylphenyl)-1-methyl-1H-indene (CID 21095571) is 2-(2,3-dimethylphenyl)-1-methyl-1H-indene.
What is the SMILES notation for 2-(2,3-dimethylphenyl)-1-methyl-1H-indene?
The canonical SMILES for 2-(2,3-dimethylphenyl)-1-methyl-1H-indene is Cc1cccc(C2=Cc3ccccc3C2C)c1C.
What is the InChIKey of 2-(2,3-dimethylphenyl)-1-methyl-1H-indene?
The InChIKey is NDKGYGKCCDKXOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18/c1-12-7-6-10-17(13(12)2)18-11-15-8-4-5-9-16(15)14(18)3/h4-11,14H,1-3H3.
What are the key properties of 2-(2,3-dimethylphenyl)-1-methyl-1H-indene?
2-(2,3-dimethylphenyl)-1-methyl-1H-indene has a molecular weight of 234.34 g/mol, XLogP of 4.96, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dimethylphenyl)-1-methyl-1H-indene is sourced from PubChem (CID 21095571), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).