2-(1-ethyl-7-methoxyindol-3-yl)propan-2-ol

C14H19NO2 — CID 117197919

IUPAC2-(1-ethyl-7-methoxyindol-3-yl)propan-2-ol
SMILESCCn1cc(C(C)(C)O)c2cccc(OC)c21
InChIInChI=1S/C14H19NO2/c1-5-15-9-11(14(2,3)16)10-7-6-8-12(17-4)13(10)15/h6-9,16H,5H2,1-4H3
InChIKeyVEWBQTYLMFHFCK-UHFFFAOYSA-N
MW233.31 g/mol
LogP2.90
Rot. Bonds3

About 2-(1-ethyl-7-methoxyindol-3-yl)propan-2-ol

2-(1-ethyl-7-methoxyindol-3-yl)propan-2-ol (PubChem CID 117197919) has the molecular formula C14H19NO2 and a molecular weight of 233.31 g/mol. Its IUPAC name is 2-(1-ethyl-7-methoxyindol-3-yl)propan-2-ol.

Molecular Properties

Compound Name2-(1-ethyl-7-methoxyindol-3-yl)propan-2-ol
PubChem CID117197919
Molecular FormulaC14H19NO2
Molecular Weight233.31 g/mol
Exact Mass233.14
IUPAC Name2-(1-ethyl-7-methoxyindol-3-yl)propan-2-ol
SMILESCCn1cc(C(C)(C)O)c2cccc(OC)c21
InChIInChI=1S/C14H19NO2/c1-5-15-9-11(14(2,3)16)10-7-6-8-12(17-4)13(10)15/h6-9,16H,5H2,1-4H3
InChIKeyVEWBQTYLMFHFCK-UHFFFAOYSA-N
XLogP2.90
TPSA34.39 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(1-ethyl-7-methoxyindol-3-yl)ethanol
CID 117197918
1-(1-ethyl-7-methoxyindol-3-yl)-N-methylpropan-2-amine
CID 117197951
3-(1-ethyl-7-methoxyindol-3-yl)propan-1-amine
CID 117197959
2-(1-ethyl-6-methoxyindol-3-yl)propan-2-ol
CID 117122288
2-(3-methoxy-2-propan-2-ylphenyl)propan-2-ol
CID 117297916
2-(1-ethyl-4-methoxyindol-2-yl)propan-2-ol
CID 117120548
2-[1-ethyl-7-(trifluoromethyl)indol-3-yl]-2-methylpropanoic acid
CID 117197367
2-(1-ethyl-7-fluoroindol-3-yl)-2-methylpropanoic acid
CID 117197726
tris(1-ethylindol-3-yl)methanol
CID 142757847
2-[1-methyl-7-(trifluoromethyl)indol-3-yl]propan-2-ol
CID 117197297
1-ethyl-3-(2-hydroxypropan-2-yl)indol-6-ol
CID 117122286
3-ethyl-7-methoxy-1-(3-methoxypropyl)indole
CID 59494067

Frequently Asked Questions

What is the IUPAC name of 2-(1-ethyl-7-methoxyindol-3-yl)propan-2-ol?
The IUPAC name of 2-(1-ethyl-7-methoxyindol-3-yl)propan-2-ol (CID 117197919) is 2-(1-ethyl-7-methoxyindol-3-yl)propan-2-ol.
What is the SMILES notation for 2-(1-ethyl-7-methoxyindol-3-yl)propan-2-ol?
The canonical SMILES for 2-(1-ethyl-7-methoxyindol-3-yl)propan-2-ol is CCn1cc(C(C)(C)O)c2cccc(OC)c21.
What is the InChIKey of 2-(1-ethyl-7-methoxyindol-3-yl)propan-2-ol?
The InChIKey is VEWBQTYLMFHFCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO2/c1-5-15-9-11(14(2,3)16)10-7-6-8-12(17-4)13(10)15/h6-9,16H,5H2,1-4H3.
What are the key properties of 2-(1-ethyl-7-methoxyindol-3-yl)propan-2-ol?
2-(1-ethyl-7-methoxyindol-3-yl)propan-2-ol has a molecular weight of 233.31 g/mol, XLogP of 2.90, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-ethyl-7-methoxyindol-3-yl)propan-2-ol is sourced from PubChem (CID 117197919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).