[1-(2-methoxypropyl)indol-7-yl]methanol

C13H17NO2 — CID 102912071

IUPAC[1-(2-methoxypropyl)indol-7-yl]methanol
SMILESCOC(C)Cn1ccc2cccc(CO)c21
InChIInChI=1S/C13H17NO2/c1-10(16-2)8-14-7-6-11-4-3-5-12(9-15)13(11)14/h3-7,10,15H,8-9H2,1-2H3
InChIKeyOSFSSPSPFRIBLE-UHFFFAOYSA-N
MW219.28 g/mol
LogP2.17
Rot. Bonds4

About [1-(2-methoxypropyl)indol-7-yl]methanol

[1-(2-methoxypropyl)indol-7-yl]methanol (PubChem CID 102912071) has the molecular formula C13H17NO2 and a molecular weight of 219.28 g/mol. Its IUPAC name is [1-(2-methoxypropyl)indol-7-yl]methanol.

Molecular Properties

Compound Name[1-(2-methoxypropyl)indol-7-yl]methanol
PubChem CID102912071
Molecular FormulaC13H17NO2
Molecular Weight219.28 g/mol
Exact Mass219.13
IUPAC Name[1-(2-methoxypropyl)indol-7-yl]methanol
SMILESCOC(C)Cn1ccc2cccc(CO)c21
InChIInChI=1S/C13H17NO2/c1-10(16-2)8-14-7-6-11-4-3-5-12(9-15)13(11)14/h3-7,10,15H,8-9H2,1-2H3
InChIKeyOSFSSPSPFRIBLE-UHFFFAOYSA-N
XLogP2.17
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 ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

methyl 2-[7-(hydroxymethyl)indol-1-yl]acetate
CID 102912191
2-[7-(hydroxymethyl)indol-1-yl]ethanol
CID 102912014
(1-prop-2-ynylindol-7-yl)methanol
CID 102912084
[1-(2-methylsulfanylethyl)indol-7-yl]methanol
CID 102912009
methyl 3-[7-(hydroxymethyl)indol-1-yl]-2,2-dimethylpropanoate
CID 102912141
2-[7-(hydroxymethyl)indol-1-yl]-N-(3-methylbutan-2-yl)acetamide
CID 102912115
1-(2,2-difluoroethyl)-7-ethylindole
CID 116618758
[1-[2-(2,2,2-trifluoroethoxy)ethyl]indol-7-yl]methanol
CID 102911952
(1-pent-4-enylindol-7-yl)methanol
CID 102912127
(1-hept-6-enylindol-7-yl)methanol
CID 107008139
[1-(3-phenylpropyl)indol-7-yl]methanol
CID 102911939
1-[7-(propylaminomethyl)indol-1-yl]propan-2-ol
CID 102914360

Frequently Asked Questions

What is the IUPAC name of [1-(2-methoxypropyl)indol-7-yl]methanol?
The IUPAC name of [1-(2-methoxypropyl)indol-7-yl]methanol (CID 102912071) is [1-(2-methoxypropyl)indol-7-yl]methanol.
What is the SMILES notation for [1-(2-methoxypropyl)indol-7-yl]methanol?
The canonical SMILES for [1-(2-methoxypropyl)indol-7-yl]methanol is COC(C)Cn1ccc2cccc(CO)c21.
What is the InChIKey of [1-(2-methoxypropyl)indol-7-yl]methanol?
The InChIKey is OSFSSPSPFRIBLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17NO2/c1-10(16-2)8-14-7-6-11-4-3-5-12(9-15)13(11)14/h3-7,10,15H,8-9H2,1-2H3.
What are the key properties of [1-(2-methoxypropyl)indol-7-yl]methanol?
[1-(2-methoxypropyl)indol-7-yl]methanol has a molecular weight of 219.28 g/mol, XLogP of 2.17, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-methoxypropyl)indol-7-yl]methanol is sourced from PubChem (CID 102912071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).