2-(1-ethyl-2-methyl-2,3-dihydroindol-4-yl)ethanol

C13H19NO — CID 117202836

IUPAC2-(1-ethyl-2-methyl-2,3-dihydroindol-4-yl)ethanol
SMILESCCN1c2cccc(CCO)c2CC1C
InChIInChI=1S/C13H19NO/c1-3-14-10(2)9-12-11(7-8-15)5-4-6-13(12)14/h4-6,10,15H,3,7-9H2,1-2H3
InChIKeyIQDZDMGGKVPFQP-UHFFFAOYSA-N
MW205.30 g/mol
LogP1.99
Rot. Bonds3

About 2-(1-ethyl-2-methyl-2,3-dihydroindol-4-yl)ethanol

2-(1-ethyl-2-methyl-2,3-dihydroindol-4-yl)ethanol (PubChem CID 117202836) has the molecular formula C13H19NO and a molecular weight of 205.30 g/mol. Its IUPAC name is 2-(1-ethyl-2-methyl-2,3-dihydroindol-4-yl)ethanol.

Molecular Properties

Compound Name2-(1-ethyl-2-methyl-2,3-dihydroindol-4-yl)ethanol
PubChem CID117202836
Molecular FormulaC13H19NO
Molecular Weight205.30 g/mol
Exact Mass205.15
IUPAC Name2-(1-ethyl-2-methyl-2,3-dihydroindol-4-yl)ethanol
SMILESCCN1c2cccc(CCO)c2CC1C
InChIInChI=1S/C13H19NO/c1-3-14-10(2)9-12-11(7-8-15)5-4-6-13(12)14/h4-6,10,15H,3,7-9H2,1-2H3
InChIKeyIQDZDMGGKVPFQP-UHFFFAOYSA-N
XLogP1.99
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.30
LogP ≤ 51.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(1-ethyl-2-methyl-2,3-dihydroindol-4-yl)propan-2-one
CID 117202850
(1-ethyl-2-methyl-3,4-dihydro-2H-quinoxalin-5-yl)methanol
CID 115096618
1-ethyl-2-(2-hydroxyethyl)-2,3-dihydroindol-4-ol
CID 117199118
(1-ethyl-2-methyl-2,3-dihydroindol-7-yl)methanamine
CID 117203939
1-benzyl-2-methyl-2,3-dihydroindol-4-ol
CID 70918044
1-(1,2-dimethyl-2,3-dihydroindol-4-yl)-N-methylmethanamine
CID 117202905
(4-chloro-1-ethyl-2,3-dihydroindol-2-yl)methanamine
CID 117198789
2-(4-bromo-2-methyl-2,3-dihydroindol-1-yl)ethanamine
CID 118050177
4-ethyl-1-methyl-2,3-dihydroindol-2-ol
CID 145223584
2-(1,3-dihydro-2-benzofuran-4-yl)ethanol
CID 83674155
1-(4-bromo-1-ethyl-2,3-dihydroindol-2-yl)ethanol
CID 117198761
1-(1-ethyl-4-hydroxy-2,3-dihydroindol-2-yl)propan-2-one
CID 117199127

Frequently Asked Questions

What is the IUPAC name of 2-(1-ethyl-2-methyl-2,3-dihydroindol-4-yl)ethanol?
The IUPAC name of 2-(1-ethyl-2-methyl-2,3-dihydroindol-4-yl)ethanol (CID 117202836) is 2-(1-ethyl-2-methyl-2,3-dihydroindol-4-yl)ethanol.
What is the SMILES notation for 2-(1-ethyl-2-methyl-2,3-dihydroindol-4-yl)ethanol?
The canonical SMILES for 2-(1-ethyl-2-methyl-2,3-dihydroindol-4-yl)ethanol is CCN1c2cccc(CCO)c2CC1C.
What is the InChIKey of 2-(1-ethyl-2-methyl-2,3-dihydroindol-4-yl)ethanol?
The InChIKey is IQDZDMGGKVPFQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO/c1-3-14-10(2)9-12-11(7-8-15)5-4-6-13(12)14/h4-6,10,15H,3,7-9H2,1-2H3.
What are the key properties of 2-(1-ethyl-2-methyl-2,3-dihydroindol-4-yl)ethanol?
2-(1-ethyl-2-methyl-2,3-dihydroindol-4-yl)ethanol has a molecular weight of 205.30 g/mol, XLogP of 1.99, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-ethyl-2-methyl-2,3-dihydroindol-4-yl)ethanol is sourced from PubChem (CID 117202836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).