1-(1H-indol-3-yl)-7-methoxynaphthalen-2-ol

C19H15NO2 — CID 142739880

IUPAC1-(1H-indol-3-yl)-7-methoxynaphthalen-2-ol
SMILESCOc1ccc2ccc(O)c(-c3c[nH]c4ccccc34)c2c1
InChIInChI=1S/C19H15NO2/c1-22-13-8-6-12-7-9-18(21)19(15(12)10-13)16-11-20-17-5-3-2-4-14(16)17/h2-11,20-21H,1H3
InChIKeyKDVLIHRHQZLHFS-UHFFFAOYSA-N
MW289.33 g/mol
LogP4.70
Rot. Bonds2

About 1-(1H-indol-3-yl)-7-methoxynaphthalen-2-ol

1-(1H-indol-3-yl)-7-methoxynaphthalen-2-ol (PubChem CID 142739880) has the molecular formula C19H15NO2 and a molecular weight of 289.33 g/mol. Its IUPAC name is 1-(1H-indol-3-yl)-7-methoxynaphthalen-2-ol.

Molecular Properties

Compound Name1-(1H-indol-3-yl)-7-methoxynaphthalen-2-ol
PubChem CID142739880
Molecular FormulaC19H15NO2
Molecular Weight289.33 g/mol
Exact Mass289.11
IUPAC Name1-(1H-indol-3-yl)-7-methoxynaphthalen-2-ol
SMILESCOc1ccc2ccc(O)c(-c3c[nH]c4ccccc34)c2c1
InChIInChI=1S/C19H15NO2/c1-22-13-8-6-12-7-9-18(21)19(15(12)10-13)16-11-20-17-5-3-2-4-14(16)17/h2-11,20-21H,1H3
InChIKeyKDVLIHRHQZLHFS-UHFFFAOYSA-N
XLogP4.70
TPSA45.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.33
LogP ≤ 54.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(1H-indol-3-yl)-7-methoxynaphthalen-2-ol?
The IUPAC name of 1-(1H-indol-3-yl)-7-methoxynaphthalen-2-ol (CID 142739880) is 1-(1H-indol-3-yl)-7-methoxynaphthalen-2-ol.
What is the SMILES notation for 1-(1H-indol-3-yl)-7-methoxynaphthalen-2-ol?
The canonical SMILES for 1-(1H-indol-3-yl)-7-methoxynaphthalen-2-ol is COc1ccc2ccc(O)c(-c3c[nH]c4ccccc34)c2c1.
What is the InChIKey of 1-(1H-indol-3-yl)-7-methoxynaphthalen-2-ol?
The InChIKey is KDVLIHRHQZLHFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15NO2/c1-22-13-8-6-12-7-9-18(21)19(15(12)10-13)16-11-20-17-5-3-2-4-14(16)17/h2-11,20-21H,1H3.
What are the key properties of 1-(1H-indol-3-yl)-7-methoxynaphthalen-2-ol?
1-(1H-indol-3-yl)-7-methoxynaphthalen-2-ol has a molecular weight of 289.33 g/mol, XLogP of 4.70, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1H-indol-3-yl)-7-methoxynaphthalen-2-ol is sourced from PubChem (CID 142739880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).