1-methyl-7-propan-2-yl-2,3-dihydro-1H-indene

C13H18 — CID 158866458

IUPAC1-methyl-7-propan-2-yl-2,3-dihydro-1H-indene
SMILESCC(C)c1cccc2c1C(C)CC2
InChIInChI=1S/C13H18/c1-9(2)12-6-4-5-11-8-7-10(3)13(11)12/h4-6,9-10H,7-8H2,1-3H3
InChIKeyIQIDTUFVWURMFC-UHFFFAOYSA-N
MW174.29 g/mol
LogP3.86
Rot. Bonds1

About 1-methyl-7-propan-2-yl-2,3-dihydro-1H-indene

1-methyl-7-propan-2-yl-2,3-dihydro-1H-indene (PubChem CID 158866458) has the molecular formula C13H18 and a molecular weight of 174.29 g/mol. Its IUPAC name is 1-methyl-7-propan-2-yl-2,3-dihydro-1H-indene.

Molecular Properties

Compound Name1-methyl-7-propan-2-yl-2,3-dihydro-1H-indene
PubChem CID158866458
Molecular FormulaC13H18
Molecular Weight174.29 g/mol
Exact Mass174.14
IUPAC Name1-methyl-7-propan-2-yl-2,3-dihydro-1H-indene
SMILESCC(C)c1cccc2c1C(C)CC2
InChIInChI=1S/C13H18/c1-9(2)12-6-4-5-11-8-7-10(3)13(11)12/h4-6,9-10H,7-8H2,1-3H3
InChIKeyIQIDTUFVWURMFC-UHFFFAOYSA-N
XLogP3.86
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.29
LogP ≤ 53.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-7-propan-2-yl-2,3-dihydro-1H-indene?
The IUPAC name of 1-methyl-7-propan-2-yl-2,3-dihydro-1H-indene (CID 158866458) is 1-methyl-7-propan-2-yl-2,3-dihydro-1H-indene.
What is the SMILES notation for 1-methyl-7-propan-2-yl-2,3-dihydro-1H-indene?
The canonical SMILES for 1-methyl-7-propan-2-yl-2,3-dihydro-1H-indene is CC(C)c1cccc2c1C(C)CC2.
What is the InChIKey of 1-methyl-7-propan-2-yl-2,3-dihydro-1H-indene?
The InChIKey is IQIDTUFVWURMFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18/c1-9(2)12-6-4-5-11-8-7-10(3)13(11)12/h4-6,9-10H,7-8H2,1-3H3.
What are the key properties of 1-methyl-7-propan-2-yl-2,3-dihydro-1H-indene?
1-methyl-7-propan-2-yl-2,3-dihydro-1H-indene has a molecular weight of 174.29 g/mol, XLogP of 3.86, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-7-propan-2-yl-2,3-dihydro-1H-indene is sourced from PubChem (CID 158866458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).