1-benzyl-5,6-dimethyl-1H-indene

C18H18 — CID 156638082

IUPAC1-benzyl-5,6-dimethyl-1H-indene
SMILESCc1cc2c(cc1C)C(Cc1ccccc1)C=C2
InChIInChI=1S/C18H18/c1-13-10-16-8-9-17(18(16)11-14(13)2)12-15-6-4-3-5-7-15/h3-11,17H,12H2,1-2H3
InChIKeyFEWXZGJAAZNEPH-UHFFFAOYSA-N
MW234.34 g/mol
LogP4.66
Rot. Bonds2

About 1-benzyl-5,6-dimethyl-1H-indene

1-benzyl-5,6-dimethyl-1H-indene (PubChem CID 156638082) has the molecular formula C18H18 and a molecular weight of 234.34 g/mol. Its IUPAC name is 1-benzyl-5,6-dimethyl-1H-indene.

Molecular Properties

Compound Name1-benzyl-5,6-dimethyl-1H-indene
PubChem CID156638082
Molecular FormulaC18H18
Molecular Weight234.34 g/mol
Exact Mass234.14
IUPAC Name1-benzyl-5,6-dimethyl-1H-indene
SMILESCc1cc2c(cc1C)C(Cc1ccccc1)C=C2
InChIInChI=1S/C18H18/c1-13-10-16-8-9-17(18(16)11-14(13)2)12-15-6-4-3-5-7-15/h3-11,17H,12H2,1-2H3
InChIKeyFEWXZGJAAZNEPH-UHFFFAOYSA-N
XLogP4.66
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 54.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

5-benzyl-1,2,3,5-tetrahydro-s-indacene;hafnium
CID 175279096
3-benzyl-5,6,7,8-tetrahydro-3H-cyclopenta[b]naphthalene;hafnium
CID 175279082
5-benzyl-2,2-dimethyl-3,5-dihydro-1H-s-indacene;hafnium
CID 175279126
1-[[2-(1H-inden-1-ylmethyl)-4,5-dimethylphenyl]methyl]-1H-indene
CID 167430736
(1R,2R)-6,7-dimethyl-2-(N-methylanilino)-1,2-dihydronaphthalen-1-ol
CID 132598538
(1R,2S)-6,7-dimethyl-2-phenyl-1,2-dihydronaphthalen-1-amine
CID 132821699
1-[(4-ethenylphenyl)methyl]-1H-indene
CID 170649356
6-benzylcyclohexa-2,4-dien-1-one
CID 14833665
4,5,11,12-tetramethylpentacyclo[6.6.6.02,7.09,14.015,20]icosa-2(7),3,5,9(14),10,12,15,17,19-nonaene
CID 4180281
[3-ethoxy-5-(1H-inden-1-ylmethyl)phenyl] acetate
CID 70271888
1-(cyclopenta-1,3-dien-1-ylmethyl)-1H-indene
CID 21188895
2-benzyl-4,6-dimethyl-2,3-dihydro-1H-inden-1-amine
CID 174285710

Frequently Asked Questions

What is the IUPAC name of 1-benzyl-5,6-dimethyl-1H-indene?
The IUPAC name of 1-benzyl-5,6-dimethyl-1H-indene (CID 156638082) is 1-benzyl-5,6-dimethyl-1H-indene.
What is the SMILES notation for 1-benzyl-5,6-dimethyl-1H-indene?
The canonical SMILES for 1-benzyl-5,6-dimethyl-1H-indene is Cc1cc2c(cc1C)C(Cc1ccccc1)C=C2.
What is the InChIKey of 1-benzyl-5,6-dimethyl-1H-indene?
The InChIKey is FEWXZGJAAZNEPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18/c1-13-10-16-8-9-17(18(16)11-14(13)2)12-15-6-4-3-5-7-15/h3-11,17H,12H2,1-2H3.
What are the key properties of 1-benzyl-5,6-dimethyl-1H-indene?
1-benzyl-5,6-dimethyl-1H-indene has a molecular weight of 234.34 g/mol, XLogP of 4.66, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzyl-5,6-dimethyl-1H-indene is sourced from PubChem (CID 156638082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).