2-(5-ethoxy-1-methylindol-3-yl)ethanol

C13H17NO2 — CID 82278619

IUPAC2-(5-ethoxy-1-methylindol-3-yl)ethanol
SMILESCCOc1ccc2c(c1)c(CCO)cn2C
InChIInChI=1S/C13H17NO2/c1-3-16-11-4-5-13-12(8-11)10(6-7-15)9-14(13)2/h4-5,8-9,15H,3,6-7H2,1-2H3
InChIKeyLOOGMASVDSZAEN-UHFFFAOYSA-N
MW219.28 g/mol
LogP2.11
Rot. Bonds4

About 2-(5-ethoxy-1-methylindol-3-yl)ethanol

2-(5-ethoxy-1-methylindol-3-yl)ethanol (PubChem CID 82278619) has the molecular formula C13H17NO2 and a molecular weight of 219.28 g/mol. Its IUPAC name is 2-(5-ethoxy-1-methylindol-3-yl)ethanol.

Molecular Properties

Compound Name2-(5-ethoxy-1-methylindol-3-yl)ethanol
PubChem CID82278619
Molecular FormulaC13H17NO2
Molecular Weight219.28 g/mol
Exact Mass219.13
IUPAC Name2-(5-ethoxy-1-methylindol-3-yl)ethanol
SMILESCCOc1ccc2c(c1)c(CCO)cn2C
InChIInChI=1S/C13H17NO2/c1-3-16-11-4-5-13-12(8-11)10(6-7-15)9-14(13)2/h4-5,8-9,15H,3,6-7H2,1-2H3
InChIKeyLOOGMASVDSZAEN-UHFFFAOYSA-N
XLogP2.11
TPSA34.39 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.28
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(5-ethoxy-1-methylindol-3-yl)-N-methylpropan-1-amine
CID 98784252
1-(5-ethoxy-1-methylindol-3-yl)propan-2-one
CID 82495412
3-(5,6-diethoxy-1-methylindol-3-yl)propan-1-ol
CID 83944719
2-(4-ethoxyphenyl)-N-[(5-methoxy-1-methylindol-3-yl)methyl]acetamide
CID 110371484
2-(4-ethoxy-2-fluorophenyl)ethanol
CID 117279842
3-(5-ethyl-1-methylindol-3-yl)propan-1-ol
CID 82278629
N-ethyl-2-(5-methoxy-1-methylindol-3-yl)ethanamine
CID 96673433
(2S)-4-(5-methoxy-1-methylindol-3-yl)butan-2-amine
CID 96673434
N-[2-(1-methyl-5-phenylmethoxyindol-3-yl)ethyl]propanamide
CID 84580371
6-ethoxy-1-methyl-3-(pyrrolidine-1-carbonyl)quinolin-4-one
CID 30133978
2-[[1-methyl-5-(trifluoromethoxy)indol-3-yl]methylamino]ethanol
CID 125472147
3-(1-methyl-5-propan-2-yloxyindol-3-yl)propan-1-amine
CID 96675442

Frequently Asked Questions

What is the IUPAC name of 2-(5-ethoxy-1-methylindol-3-yl)ethanol?
The IUPAC name of 2-(5-ethoxy-1-methylindol-3-yl)ethanol (CID 82278619) is 2-(5-ethoxy-1-methylindol-3-yl)ethanol.
What is the SMILES notation for 2-(5-ethoxy-1-methylindol-3-yl)ethanol?
The canonical SMILES for 2-(5-ethoxy-1-methylindol-3-yl)ethanol is CCOc1ccc2c(c1)c(CCO)cn2C.
What is the InChIKey of 2-(5-ethoxy-1-methylindol-3-yl)ethanol?
The InChIKey is LOOGMASVDSZAEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17NO2/c1-3-16-11-4-5-13-12(8-11)10(6-7-15)9-14(13)2/h4-5,8-9,15H,3,6-7H2,1-2H3.
What are the key properties of 2-(5-ethoxy-1-methylindol-3-yl)ethanol?
2-(5-ethoxy-1-methylindol-3-yl)ethanol has a molecular weight of 219.28 g/mol, XLogP of 2.11, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-ethoxy-1-methylindol-3-yl)ethanol is sourced from PubChem (CID 82278619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).