3-(5,6-diethoxyindol-1-yl)propan-1-ol

C15H21NO3 — CID 83944745

IUPAC3-(5,6-diethoxyindol-1-yl)propan-1-ol
SMILESCCOc1cc2ccn(CCCO)c2cc1OCC
InChIInChI=1S/C15H21NO3/c1-3-18-14-10-12-6-8-16(7-5-9-17)13(12)11-15(14)19-4-2/h6,8,10-11,17H,3-5,7,9H2,1-2H3
InChIKeyIFAZAEJBHCFRSP-UHFFFAOYSA-N
MW263.34 g/mol
LogP2.82
Rot. Bonds7

About 3-(5,6-diethoxyindol-1-yl)propan-1-ol

3-(5,6-diethoxyindol-1-yl)propan-1-ol (PubChem CID 83944745) has the molecular formula C15H21NO3 and a molecular weight of 263.34 g/mol. Its IUPAC name is 3-(5,6-diethoxyindol-1-yl)propan-1-ol.

Molecular Properties

Compound Name3-(5,6-diethoxyindol-1-yl)propan-1-ol
PubChem CID83944745
Molecular FormulaC15H21NO3
Molecular Weight263.34 g/mol
Exact Mass263.15
IUPAC Name3-(5,6-diethoxyindol-1-yl)propan-1-ol
SMILESCCOc1cc2ccn(CCCO)c2cc1OCC
InChIInChI=1S/C15H21NO3/c1-3-18-14-10-12-6-8-16(7-5-9-17)13(12)11-15(14)19-4-2/h6,8,10-11,17H,3-5,7,9H2,1-2H3
InChIKeyIFAZAEJBHCFRSP-UHFFFAOYSA-N
XLogP2.82
TPSA43.62 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(5,6-diethoxyindol-1-yl)propan-1-amine
CID 83948448
3-(6-chloro-5-methoxyindol-1-yl)propan-1-ol
CID 83944491
2-(5,6-diethoxyindol-1-yl)acetic acid
CID 83944709
3-[5-(ethylaminomethyl)indol-1-yl]propan-1-ol
CID 102915831
6-(5-methoxyindol-1-yl)hexan-1-ol
CID 107707082
3-[6-(aminomethyl)indol-1-yl]propan-1-ol
CID 102916381
2-(5,6-dimethylindol-1-yl)ethanol
CID 83944319
3-(1-butyl-5,6-diethoxyindol-3-yl)propan-1-ol
CID 83944729
2-(4-ethoxyindol-1-yl)ethanol
CID 83174332
1-(3-hydroxypropyl)indole-6-carbaldehyde
CID 102911092
1-(3-hydroxypropyl)indole-6-carbonitrile
CID 15490884
3-(5,6-dimethoxyindol-1-yl)propanenitrile
CID 21216857

Frequently Asked Questions

What is the IUPAC name of 3-(5,6-diethoxyindol-1-yl)propan-1-ol?
The IUPAC name of 3-(5,6-diethoxyindol-1-yl)propan-1-ol (CID 83944745) is 3-(5,6-diethoxyindol-1-yl)propan-1-ol.
What is the SMILES notation for 3-(5,6-diethoxyindol-1-yl)propan-1-ol?
The canonical SMILES for 3-(5,6-diethoxyindol-1-yl)propan-1-ol is CCOc1cc2ccn(CCCO)c2cc1OCC.
What is the InChIKey of 3-(5,6-diethoxyindol-1-yl)propan-1-ol?
The InChIKey is IFAZAEJBHCFRSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO3/c1-3-18-14-10-12-6-8-16(7-5-9-17)13(12)11-15(14)19-4-2/h6,8,10-11,17H,3-5,7,9H2,1-2H3.
What are the key properties of 3-(5,6-diethoxyindol-1-yl)propan-1-ol?
3-(5,6-diethoxyindol-1-yl)propan-1-ol has a molecular weight of 263.34 g/mol, XLogP of 2.82, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5,6-diethoxyindol-1-yl)propan-1-ol is sourced from PubChem (CID 83944745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).