5-methyl-2,3-dihydro-1H-indene;5-methyl-2,3,4,7-tetrahydro-1H-indene

C20H26 — CID 164996395

IUPAC5-methyl-2,3-dihydro-1H-indene;5-methyl-2,3,4,7-tetrahydro-1H-indene
SMILESCC1=CCC2=C(CCC2)C1.Cc1ccc2c(c1)CCC2
InChIInChI=1S/C10H14.C10H12/c2*1-8-5-6-9-3-2-4-10(9)7-8/h5H,2-4,6-7H2,1H3;5-7H,2-4H2,1H3
InChIKeyHPRKYFIVLHZSPQ-UHFFFAOYSA-N
MW266.43 g/mol
LogP5.69
Rot. Bonds

About 5-methyl-2,3-dihydro-1H-indene;5-methyl-2,3,4,7-tetrahydro-1H-indene

5-methyl-2,3-dihydro-1H-indene;5-methyl-2,3,4,7-tetrahydro-1H-indene (PubChem CID 164996395) has the molecular formula C20H26 and a molecular weight of 266.43 g/mol. Its IUPAC name is 5-methyl-2,3-dihydro-1H-indene;5-methyl-2,3,4,7-tetrahydro-1H-indene.

Molecular Properties

Compound Name5-methyl-2,3-dihydro-1H-indene;5-methyl-2,3,4,7-tetrahydro-1H-indene
PubChem CID164996395
Molecular FormulaC20H26
Molecular Weight266.43 g/mol
Exact Mass266.20
IUPAC Name5-methyl-2,3-dihydro-1H-indene;5-methyl-2,3,4,7-tetrahydro-1H-indene
SMILESCC1=CCC2=C(CCC2)C1.Cc1ccc2c(c1)CCC2
InChIInChI=1S/C10H14.C10H12/c2*1-8-5-6-9-3-2-4-10(9)7-8/h5H,2-4,6-7H2,1H3;5-7H,2-4H2,1H3
InChIKeyHPRKYFIVLHZSPQ-UHFFFAOYSA-N
XLogP5.69
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500266.43
LogP ≤ 55.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

7-methyl-2,3,4,5-tetrahydro-1H-3-benzazepine
CID 55264670
5-(4-methylphenyl)-2,3-dihydro-1H-indene
CID 59217485
5,13-dimethyltricyclo[9.4.0.02,7]pentadeca-1(11),2(7),3,5,12,14-hexaene
CID 23561339
1,2-dichlorobenzene;6-methyl-1,2,3,4-tetrahydronaphthalene
CID 143596446
(15Z)-6-methyltricyclo[9.6.0.03,8]heptadeca-1(11),3(8),4,6,15-pentaene
CID 142100998
5-methyltricyclo[9.4.0.02,7]pentadeca-1(15),2(7),3,5,11,13-hexaene
CID 90783732
7-methyl-2,3,4,5-tetrahydro-1H-2-benzazepine
CID 58285092
6-methyl-3-methylidene-2,4-dihydro-1H-naphthalene
CID 144794915
ethane;5-ethyl-1,2,3,4-tetrahydronaphthalene;bis(6-methyl-1,2,3,4-tetrahydronaphthalene)
CID 142243189
3-methyl-6,7,8,9,10,11-hexahydro-5H-cycloocta[a]indene
CID 53360534
2-(2,3-dihydro-1H-inden-5-yl)-1-(2,4-dimethylphenyl)ethanamine
CID 115864870
N-[1-(2,5-dimethylphenyl)ethyl]-2,3-dihydro-1H-inden-5-amine
CID 43109710

Frequently Asked Questions

What is the IUPAC name of 5-methyl-2,3-dihydro-1H-indene;5-methyl-2,3,4,7-tetrahydro-1H-indene?
The IUPAC name of 5-methyl-2,3-dihydro-1H-indene;5-methyl-2,3,4,7-tetrahydro-1H-indene (CID 164996395) is 5-methyl-2,3-dihydro-1H-indene;5-methyl-2,3,4,7-tetrahydro-1H-indene.
What is the SMILES notation for 5-methyl-2,3-dihydro-1H-indene;5-methyl-2,3,4,7-tetrahydro-1H-indene?
The canonical SMILES for 5-methyl-2,3-dihydro-1H-indene;5-methyl-2,3,4,7-tetrahydro-1H-indene is CC1=CCC2=C(CCC2)C1.Cc1ccc2c(c1)CCC2.
What is the InChIKey of 5-methyl-2,3-dihydro-1H-indene;5-methyl-2,3,4,7-tetrahydro-1H-indene?
The InChIKey is HPRKYFIVLHZSPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14.C10H12/c2*1-8-5-6-9-3-2-4-10(9)7-8/h5H,2-4,6-7H2,1H3;5-7H,2-4H2,1H3.
What are the key properties of 5-methyl-2,3-dihydro-1H-indene;5-methyl-2,3,4,7-tetrahydro-1H-indene?
5-methyl-2,3-dihydro-1H-indene;5-methyl-2,3,4,7-tetrahydro-1H-indene has a molecular weight of 266.43 g/mol, XLogP of 5.69, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-2,3-dihydro-1H-indene;5-methyl-2,3,4,7-tetrahydro-1H-indene is sourced from PubChem (CID 164996395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).