1-methyl-5-phenyl-2,3-dihydro-1H-indene

C16H16 — CID 3054951

IUPAC1-methyl-5-phenyl-2,3-dihydro-1H-indene
SMILESCC1CCc2cc(-c3ccccc3)ccc21
InChIInChI=1S/C16H16/c1-12-7-8-15-11-14(9-10-16(12)15)13-5-3-2-4-6-13/h2-6,9-12H,7-8H2,1H3
InChIKeyHYACLZWJAWSGFH-UHFFFAOYSA-N
MW208.30 g/mol
LogP4.40
Rot. Bonds1

About 1-methyl-5-phenyl-2,3-dihydro-1H-indene

1-methyl-5-phenyl-2,3-dihydro-1H-indene (PubChem CID 3054951) has the molecular formula C16H16 and a molecular weight of 208.30 g/mol. Its IUPAC name is 1-methyl-5-phenyl-2,3-dihydro-1H-indene.

Molecular Properties

Compound Name1-methyl-5-phenyl-2,3-dihydro-1H-indene
PubChem CID3054951
Molecular FormulaC16H16
Molecular Weight208.30 g/mol
Exact Mass208.13
IUPAC Name1-methyl-5-phenyl-2,3-dihydro-1H-indene
SMILESCC1CCc2cc(-c3ccccc3)ccc21
InChIInChI=1S/C16H16/c1-12-7-8-15-11-14(9-10-16(12)15)13-5-3-2-4-6-13/h2-6,9-12H,7-8H2,1H3
InChIKeyHYACLZWJAWSGFH-UHFFFAOYSA-N
XLogP4.40
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.30
LogP ≤ 54.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-5-phenyl-2,3-dihydro-1H-indene?
The IUPAC name of 1-methyl-5-phenyl-2,3-dihydro-1H-indene (CID 3054951) is 1-methyl-5-phenyl-2,3-dihydro-1H-indene.
What is the SMILES notation for 1-methyl-5-phenyl-2,3-dihydro-1H-indene?
The canonical SMILES for 1-methyl-5-phenyl-2,3-dihydro-1H-indene is CC1CCc2cc(-c3ccccc3)ccc21.
What is the InChIKey of 1-methyl-5-phenyl-2,3-dihydro-1H-indene?
The InChIKey is HYACLZWJAWSGFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16/c1-12-7-8-15-11-14(9-10-16(12)15)13-5-3-2-4-6-13/h2-6,9-12H,7-8H2,1H3.
What are the key properties of 1-methyl-5-phenyl-2,3-dihydro-1H-indene?
1-methyl-5-phenyl-2,3-dihydro-1H-indene has a molecular weight of 208.30 g/mol, XLogP of 4.40, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-5-phenyl-2,3-dihydro-1H-indene is sourced from PubChem (CID 3054951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).