[1-(methoxymethyl)indol-2-yl]-phenylmethanol

C17H17NO2 — CID 11842269

IUPAC[1-(methoxymethyl)indol-2-yl]-phenylmethanol
SMILESCOCn1c(C(O)c2ccccc2)cc2ccccc21
InChIInChI=1S/C17H17NO2/c1-20-12-18-15-10-6-5-9-14(15)11-16(18)17(19)13-7-3-2-4-8-13/h2-11,17,19H,12H2,1H3
InChIKeyAXZUOSOTBNFOGE-UHFFFAOYSA-N
MW267.33 g/mol
LogP3.33
Rot. Bonds4

About [1-(methoxymethyl)indol-2-yl]-phenylmethanol

[1-(methoxymethyl)indol-2-yl]-phenylmethanol (PubChem CID 11842269) has the molecular formula C17H17NO2 and a molecular weight of 267.33 g/mol. Its IUPAC name is [1-(methoxymethyl)indol-2-yl]-phenylmethanol.

Molecular Properties

Compound Name[1-(methoxymethyl)indol-2-yl]-phenylmethanol
PubChem CID11842269
Molecular FormulaC17H17NO2
Molecular Weight267.33 g/mol
Exact Mass267.13
IUPAC Name[1-(methoxymethyl)indol-2-yl]-phenylmethanol
SMILESCOCn1c(C(O)c2ccccc2)cc2ccccc21
InChIInChI=1S/C17H17NO2/c1-20-12-18-15-10-6-5-9-14(15)11-16(18)17(19)13-7-3-2-4-8-13/h2-11,17,19H,12H2,1H3
InChIKeyAXZUOSOTBNFOGE-UHFFFAOYSA-N
XLogP3.33
TPSA34.39 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.33
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [1-(methoxymethyl)indol-2-yl]-phenylmethanol?
The IUPAC name of [1-(methoxymethyl)indol-2-yl]-phenylmethanol (CID 11842269) is [1-(methoxymethyl)indol-2-yl]-phenylmethanol.
What is the SMILES notation for [1-(methoxymethyl)indol-2-yl]-phenylmethanol?
The canonical SMILES for [1-(methoxymethyl)indol-2-yl]-phenylmethanol is COCn1c(C(O)c2ccccc2)cc2ccccc21.
What is the InChIKey of [1-(methoxymethyl)indol-2-yl]-phenylmethanol?
The InChIKey is AXZUOSOTBNFOGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17NO2/c1-20-12-18-15-10-6-5-9-14(15)11-16(18)17(19)13-7-3-2-4-8-13/h2-11,17,19H,12H2,1H3.
What are the key properties of [1-(methoxymethyl)indol-2-yl]-phenylmethanol?
[1-(methoxymethyl)indol-2-yl]-phenylmethanol has a molecular weight of 267.33 g/mol, XLogP of 3.33, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(methoxymethyl)indol-2-yl]-phenylmethanol is sourced from PubChem (CID 11842269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).