2-(5-propan-2-yl-2,3-dihydro-1H-indol-3-yl)ethanol

C13H19NO — CID 15491242

IUPAC2-(5-propan-2-yl-2,3-dihydro-1H-indol-3-yl)ethanol
SMILESCC(C)c1ccc2c(c1)C(CCO)CN2
InChIInChI=1S/C13H19NO/c1-9(2)10-3-4-13-12(7-10)11(5-6-15)8-14-13/h3-4,7,9,11,14-15H,5-6,8H2,1-2H3
InChIKeyCZEVEGIGRVJQTI-UHFFFAOYSA-N
MW205.30 g/mol
LogP2.70
Rot. Bonds3

About 2-(5-propan-2-yl-2,3-dihydro-1H-indol-3-yl)ethanol

2-(5-propan-2-yl-2,3-dihydro-1H-indol-3-yl)ethanol (PubChem CID 15491242) has the molecular formula C13H19NO and a molecular weight of 205.30 g/mol. Its IUPAC name is 2-(5-propan-2-yl-2,3-dihydro-1H-indol-3-yl)ethanol.

Molecular Properties

Compound Name2-(5-propan-2-yl-2,3-dihydro-1H-indol-3-yl)ethanol
PubChem CID15491242
Molecular FormulaC13H19NO
Molecular Weight205.30 g/mol
Exact Mass205.15
IUPAC Name2-(5-propan-2-yl-2,3-dihydro-1H-indol-3-yl)ethanol
SMILESCC(C)c1ccc2c(c1)C(CCO)CN2
InChIInChI=1S/C13H19NO/c1-9(2)10-3-4-13-12(7-10)11(5-6-15)8-14-13/h3-4,7,9,11,14-15H,5-6,8H2,1-2H3
InChIKeyCZEVEGIGRVJQTI-UHFFFAOYSA-N
XLogP2.70
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.30
LogP ≤ 52.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(5-propan-2-yl-2,3-dihydro-1H-indol-3-yl)ethanol?
The IUPAC name of 2-(5-propan-2-yl-2,3-dihydro-1H-indol-3-yl)ethanol (CID 15491242) is 2-(5-propan-2-yl-2,3-dihydro-1H-indol-3-yl)ethanol.
What is the SMILES notation for 2-(5-propan-2-yl-2,3-dihydro-1H-indol-3-yl)ethanol?
The canonical SMILES for 2-(5-propan-2-yl-2,3-dihydro-1H-indol-3-yl)ethanol is CC(C)c1ccc2c(c1)C(CCO)CN2.
What is the InChIKey of 2-(5-propan-2-yl-2,3-dihydro-1H-indol-3-yl)ethanol?
The InChIKey is CZEVEGIGRVJQTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO/c1-9(2)10-3-4-13-12(7-10)11(5-6-15)8-14-13/h3-4,7,9,11,14-15H,5-6,8H2,1-2H3.
What are the key properties of 2-(5-propan-2-yl-2,3-dihydro-1H-indol-3-yl)ethanol?
2-(5-propan-2-yl-2,3-dihydro-1H-indol-3-yl)ethanol has a molecular weight of 205.30 g/mol, XLogP of 2.70, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-propan-2-yl-2,3-dihydro-1H-indol-3-yl)ethanol is sourced from PubChem (CID 15491242), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).