2-(6-ethyl-3-methyl-2,3-dihydro-1H-inden-1-yl)ethanol

C14H20O — CID 82077013

IUPAC2-(6-ethyl-3-methyl-2,3-dihydro-1H-inden-1-yl)ethanol
SMILESCCc1ccc2c(c1)C(CCO)CC2C
InChIInChI=1S/C14H20O/c1-3-11-4-5-13-10(2)8-12(6-7-15)14(13)9-11/h4-5,9-10,12,15H,3,6-8H2,1-2H3
InChIKeyAGWOANWUYWQDED-UHFFFAOYSA-N
MW204.31 g/mol
LogP3.22
Rot. Bonds3

About 2-(6-ethyl-3-methyl-2,3-dihydro-1H-inden-1-yl)ethanol

2-(6-ethyl-3-methyl-2,3-dihydro-1H-inden-1-yl)ethanol (PubChem CID 82077013) has the molecular formula C14H20O and a molecular weight of 204.31 g/mol. Its IUPAC name is 2-(6-ethyl-3-methyl-2,3-dihydro-1H-inden-1-yl)ethanol.

Molecular Properties

Compound Name2-(6-ethyl-3-methyl-2,3-dihydro-1H-inden-1-yl)ethanol
PubChem CID82077013
Molecular FormulaC14H20O
Molecular Weight204.31 g/mol
Exact Mass204.15
IUPAC Name2-(6-ethyl-3-methyl-2,3-dihydro-1H-inden-1-yl)ethanol
SMILESCCc1ccc2c(c1)C(CCO)CC2C
InChIInChI=1S/C14H20O/c1-3-11-4-5-13-10(2)8-12(6-7-15)14(13)9-11/h4-5,9-10,12,15H,3,6-8H2,1-2H3
InChIKeyAGWOANWUYWQDED-UHFFFAOYSA-N
XLogP3.22
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.31
LogP ≤ 53.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-(6-ethyl-3-methyl-2,3-dihydro-1H-inden-1-yl)ethanol?
The IUPAC name of 2-(6-ethyl-3-methyl-2,3-dihydro-1H-inden-1-yl)ethanol (CID 82077013) is 2-(6-ethyl-3-methyl-2,3-dihydro-1H-inden-1-yl)ethanol.
What is the SMILES notation for 2-(6-ethyl-3-methyl-2,3-dihydro-1H-inden-1-yl)ethanol?
The canonical SMILES for 2-(6-ethyl-3-methyl-2,3-dihydro-1H-inden-1-yl)ethanol is CCc1ccc2c(c1)C(CCO)CC2C.
What is the InChIKey of 2-(6-ethyl-3-methyl-2,3-dihydro-1H-inden-1-yl)ethanol?
The InChIKey is AGWOANWUYWQDED-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20O/c1-3-11-4-5-13-10(2)8-12(6-7-15)14(13)9-11/h4-5,9-10,12,15H,3,6-8H2,1-2H3.
What are the key properties of 2-(6-ethyl-3-methyl-2,3-dihydro-1H-inden-1-yl)ethanol?
2-(6-ethyl-3-methyl-2,3-dihydro-1H-inden-1-yl)ethanol has a molecular weight of 204.31 g/mol, XLogP of 3.22, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-ethyl-3-methyl-2,3-dihydro-1H-inden-1-yl)ethanol is sourced from PubChem (CID 82077013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).