2,4-dimethyl-7-(1-methylcyclohexyl)-1H-indene

C18H24 — CID 56994043

IUPAC2,4-dimethyl-7-(1-methylcyclohexyl)-1H-indene
SMILESCC1=Cc2c(C)ccc(C3(C)CCCCC3)c2C1
InChIInChI=1S/C18H24/c1-13-11-15-14(2)7-8-17(16(15)12-13)18(3)9-5-4-6-10-18/h7-8,11H,4-6,9-10,12H2,1-3H3
InChIKeyDEJFCENASSUHSC-UHFFFAOYSA-N
MW240.39 g/mol
LogP5.18
Rot. Bonds1

About 2,4-dimethyl-7-(1-methylcyclohexyl)-1H-indene

2,4-dimethyl-7-(1-methylcyclohexyl)-1H-indene (PubChem CID 56994043) has the molecular formula C18H24 and a molecular weight of 240.39 g/mol. Its IUPAC name is 2,4-dimethyl-7-(1-methylcyclohexyl)-1H-indene.

Molecular Properties

Compound Name2,4-dimethyl-7-(1-methylcyclohexyl)-1H-indene
PubChem CID56994043
Molecular FormulaC18H24
Molecular Weight240.39 g/mol
Exact Mass240.19
IUPAC Name2,4-dimethyl-7-(1-methylcyclohexyl)-1H-indene
SMILESCC1=Cc2c(C)ccc(C3(C)CCCCC3)c2C1
InChIInChI=1S/C18H24/c1-13-11-15-14(2)7-8-17(16(15)12-13)18(3)9-5-4-6-10-18/h7-8,11H,4-6,9-10,12H2,1-3H3
InChIKeyDEJFCENASSUHSC-UHFFFAOYSA-N
XLogP5.18
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500240.39
LogP ≤ 55.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

4-fluoro-1-methyl-2-(1-methylcyclohexyl)benzene
CID 123739587
7-(3,5-ditert-butylphenyl)-2,4-dimethyl-1H-indene
CID 123862995
3a,6-dimethyl-2,3,4,5-tetrahydro-1H-acenaphthylene
CID 177102559
2,4-dimethyl-6-(1-methylcyclohexyl)phenol
CID 6485
4-chloro-2-fluoro-1-(1-methylcyclohexyl)benzene
CID 175792533
1-bromo-2-(1-methylcyclohexyl)benzene
CID 131090981
4-methyl-2,6-bis(1-methylcyclohexyl)phenol
CID 22281157
2-iodo-4,7-dimethyl-1H-indene
CID 145268239
2-bromo-4,7-dimethyl-1H-indene
CID 58975409
[1-(2,3-difluoro-4-methylphenyl)cyclohexyl]methanamine
CID 117351215
4-bromo-1-methoxy-2-(1-methylcyclohexyl)benzene
CID 10684359
4-[2-[4-hydroxy-3-methyl-5-(1-methylcyclohexyl)phenyl]propan-2-yl]-2-methyl-6-(1-methylcyclohexyl)phenol
CID 170685769

Frequently Asked Questions

What is the IUPAC name of 2,4-dimethyl-7-(1-methylcyclohexyl)-1H-indene?
The IUPAC name of 2,4-dimethyl-7-(1-methylcyclohexyl)-1H-indene (CID 56994043) is 2,4-dimethyl-7-(1-methylcyclohexyl)-1H-indene.
What is the SMILES notation for 2,4-dimethyl-7-(1-methylcyclohexyl)-1H-indene?
The canonical SMILES for 2,4-dimethyl-7-(1-methylcyclohexyl)-1H-indene is CC1=Cc2c(C)ccc(C3(C)CCCCC3)c2C1.
What is the InChIKey of 2,4-dimethyl-7-(1-methylcyclohexyl)-1H-indene?
The InChIKey is DEJFCENASSUHSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24/c1-13-11-15-14(2)7-8-17(16(15)12-13)18(3)9-5-4-6-10-18/h7-8,11H,4-6,9-10,12H2,1-3H3.
What are the key properties of 2,4-dimethyl-7-(1-methylcyclohexyl)-1H-indene?
2,4-dimethyl-7-(1-methylcyclohexyl)-1H-indene has a molecular weight of 240.39 g/mol, XLogP of 5.18, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethyl-7-(1-methylcyclohexyl)-1H-indene is sourced from PubChem (CID 56994043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).