2-(2,2-dimethylpropyl)-5-methoxy-2,3-dihydro-1H-indene

C15H22O — CID 134338473

IUPAC2-(2,2-dimethylpropyl)-5-methoxy-2,3-dihydro-1H-indene
SMILESCOc1ccc2c(c1)CC(CC(C)(C)C)C2
InChIInChI=1S/C15H22O/c1-15(2,3)10-11-7-12-5-6-14(16-4)9-13(12)8-11/h5-6,9,11H,7-8,10H2,1-4H3
InChIKeyCAYWBYVYSJYKRM-UHFFFAOYSA-N
MW218.34 g/mol
LogP3.85
Rot. Bonds2

About 2-(2,2-dimethylpropyl)-5-methoxy-2,3-dihydro-1H-indene

2-(2,2-dimethylpropyl)-5-methoxy-2,3-dihydro-1H-indene (PubChem CID 134338473) has the molecular formula C15H22O and a molecular weight of 218.34 g/mol. Its IUPAC name is 2-(2,2-dimethylpropyl)-5-methoxy-2,3-dihydro-1H-indene.

Molecular Properties

Compound Name2-(2,2-dimethylpropyl)-5-methoxy-2,3-dihydro-1H-indene
PubChem CID134338473
Molecular FormulaC15H22O
Molecular Weight218.34 g/mol
Exact Mass218.17
IUPAC Name2-(2,2-dimethylpropyl)-5-methoxy-2,3-dihydro-1H-indene
SMILESCOc1ccc2c(c1)CC(CC(C)(C)C)C2
InChIInChI=1S/C15H22O/c1-15(2,3)10-11-7-12-5-6-14(16-4)9-13(12)8-11/h5-6,9,11H,7-8,10H2,1-4H3
InChIKeyCAYWBYVYSJYKRM-UHFFFAOYSA-N
XLogP3.85
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.34
LogP ≤ 53.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

(2R)-5-methoxy-N-methyl-2,3-dihydro-1H-inden-2-amine
CID 86334379
(6-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)methanamine
CID 15718592
N-ethyl-5-methoxy-N-methyl-2,3-dihydro-1H-inden-2-amine
CID 23397076
3-(2,2-dimethylpropyl)-6-methoxy-3,4-dihydro-2H-isoquinolin-1-one
CID 20608553
2-(6-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)acetamide
CID 131876575
(2R,5R)-1-(5-methoxy-2,3-dihydro-1H-inden-2-yl)-2,5-dimethylpyrrolidine
CID 69028967
3-ethyl-7-methoxy-1,2,3,4-tetrahydroisoquinoline
CID 62375759
2-azido-5-methoxy-2,3-dihydro-1H-indene
CID 132528606
8-benzyl-2-methoxy-5,7,8,9-tetrahydrobenzo[7]annulen-6-imine
CID 145489426
7-methoxy-2-methyl-1,2,3,4-tetrahydronaphthalene;hydrochloride
CID 19889857
2-[[(2R)-6-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl]methyl]phenol
CID 124560099
5-methoxy-11-azatricyclo[8.2.2.03,8]tetradeca-3(8),4,6-triene
CID 20537552

Frequently Asked Questions

What is the IUPAC name of 2-(2,2-dimethylpropyl)-5-methoxy-2,3-dihydro-1H-indene?
The IUPAC name of 2-(2,2-dimethylpropyl)-5-methoxy-2,3-dihydro-1H-indene (CID 134338473) is 2-(2,2-dimethylpropyl)-5-methoxy-2,3-dihydro-1H-indene.
What is the SMILES notation for 2-(2,2-dimethylpropyl)-5-methoxy-2,3-dihydro-1H-indene?
The canonical SMILES for 2-(2,2-dimethylpropyl)-5-methoxy-2,3-dihydro-1H-indene is COc1ccc2c(c1)CC(CC(C)(C)C)C2.
What is the InChIKey of 2-(2,2-dimethylpropyl)-5-methoxy-2,3-dihydro-1H-indene?
The InChIKey is CAYWBYVYSJYKRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22O/c1-15(2,3)10-11-7-12-5-6-14(16-4)9-13(12)8-11/h5-6,9,11H,7-8,10H2,1-4H3.
What are the key properties of 2-(2,2-dimethylpropyl)-5-methoxy-2,3-dihydro-1H-indene?
2-(2,2-dimethylpropyl)-5-methoxy-2,3-dihydro-1H-indene has a molecular weight of 218.34 g/mol, XLogP of 3.85, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,2-dimethylpropyl)-5-methoxy-2,3-dihydro-1H-indene is sourced from PubChem (CID 134338473), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).