1,2-dimethoxy-5-methyl-3-propyl-1H-indene

C15H20O2 — CID 86218046

IUPAC1,2-dimethoxy-5-methyl-3-propyl-1H-indene
SMILESCCCC1=C(OC)C(OC)c2ccc(C)cc21
InChIInChI=1S/C15H20O2/c1-5-6-11-13-9-10(2)7-8-12(13)15(17-4)14(11)16-3/h7-9,15H,5-6H2,1-4H3
InChIKeyDQZGKSYAQXVSGN-UHFFFAOYSA-N
MW232.32 g/mol
LogP3.85
Rot. Bonds4

About 1,2-dimethoxy-5-methyl-3-propyl-1H-indene

1,2-dimethoxy-5-methyl-3-propyl-1H-indene (PubChem CID 86218046) has the molecular formula C15H20O2 and a molecular weight of 232.32 g/mol. Its IUPAC name is 1,2-dimethoxy-5-methyl-3-propyl-1H-indene.

Molecular Properties

Compound Name1,2-dimethoxy-5-methyl-3-propyl-1H-indene
PubChem CID86218046
Molecular FormulaC15H20O2
Molecular Weight232.32 g/mol
Exact Mass232.15
IUPAC Name1,2-dimethoxy-5-methyl-3-propyl-1H-indene
SMILESCCCC1=C(OC)C(OC)c2ccc(C)cc21
InChIInChI=1S/C15H20O2/c1-5-6-11-13-9-10(2)7-8-12(13)15(17-4)14(11)16-3/h7-9,15H,5-6H2,1-4H3
InChIKeyDQZGKSYAQXVSGN-UHFFFAOYSA-N
XLogP3.85
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.32
LogP ≤ 53.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

5-methyl-2,3-dipropyl-1H-inden-1-ol
CID 134983328
3-chloro-6-methyl-2-propylnaphthalene-1,4-dione
CID 19872865
N-[[5-(2-methoxy-5-methylphenyl)furan-2-yl]methyl]ethanamine
CID 106887131
2-methyl-7-propylanthracene-9,10-dione
CID 118026365
3-butoxy-6-methyl-3H-2-benzofuran-1-one
CID 11975113
5-methyl-2-propylbenzaldehyde
CID 23586663
1-methoxy-2-[2-methoxy-3-(2-methoxy-5-methylphenyl)phenyl]-4-methylbenzene
CID 13360661
2,7,9-trimethoxy-9H-fluorene
CID 155898925
diethyl 2-(6-methyl-2-oxo-3H-1-benzofuran-3-yl)propanedioate
CID 11426740
3-[2-(ethylaminomethyl)-5-methylphenyl]-4-methoxybenzonitrile
CID 106951073
1,4-dimethyl-2-(3-propylphenyl)benzene
CID 173395390
diethyl 3-hydroxy-6-methyl-3H-indene-1,2-dicarboxylate
CID 134983670

Frequently Asked Questions

What is the IUPAC name of 1,2-dimethoxy-5-methyl-3-propyl-1H-indene?
The IUPAC name of 1,2-dimethoxy-5-methyl-3-propyl-1H-indene (CID 86218046) is 1,2-dimethoxy-5-methyl-3-propyl-1H-indene.
What is the SMILES notation for 1,2-dimethoxy-5-methyl-3-propyl-1H-indene?
The canonical SMILES for 1,2-dimethoxy-5-methyl-3-propyl-1H-indene is CCCC1=C(OC)C(OC)c2ccc(C)cc21.
What is the InChIKey of 1,2-dimethoxy-5-methyl-3-propyl-1H-indene?
The InChIKey is DQZGKSYAQXVSGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20O2/c1-5-6-11-13-9-10(2)7-8-12(13)15(17-4)14(11)16-3/h7-9,15H,5-6H2,1-4H3.
What are the key properties of 1,2-dimethoxy-5-methyl-3-propyl-1H-indene?
1,2-dimethoxy-5-methyl-3-propyl-1H-indene has a molecular weight of 232.32 g/mol, XLogP of 3.85, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-dimethoxy-5-methyl-3-propyl-1H-indene is sourced from PubChem (CID 86218046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).