1-(1H-benzo[g]indol-3-yl)-6-methoxynaphthalen-2-ol

C23H17NO2 — CID 142739888

IUPAC1-(1H-benzo[g]indol-3-yl)-6-methoxynaphthalen-2-ol
SMILESCOc1ccc2c(-c3c[nH]c4c3ccc3ccccc34)c(O)ccc2c1
InChIInChI=1S/C23H17NO2/c1-26-16-8-10-17-15(12-16)7-11-21(25)22(17)20-13-24-23-18-5-3-2-4-14(18)6-9-19(20)23/h2-13,24-25H,1H3
InChIKeyGKYVLHXLEQWHLP-UHFFFAOYSA-N
MW339.39 g/mol
LogP5.86
Rot. Bonds2

About 1-(1H-benzo[g]indol-3-yl)-6-methoxynaphthalen-2-ol

1-(1H-benzo[g]indol-3-yl)-6-methoxynaphthalen-2-ol (PubChem CID 142739888) has the molecular formula C23H17NO2 and a molecular weight of 339.39 g/mol. Its IUPAC name is 1-(1H-benzo[g]indol-3-yl)-6-methoxynaphthalen-2-ol.

Molecular Properties

Compound Name1-(1H-benzo[g]indol-3-yl)-6-methoxynaphthalen-2-ol
PubChem CID142739888
Molecular FormulaC23H17NO2
Molecular Weight339.39 g/mol
Exact Mass339.13
IUPAC Name1-(1H-benzo[g]indol-3-yl)-6-methoxynaphthalen-2-ol
SMILESCOc1ccc2c(-c3c[nH]c4c3ccc3ccccc34)c(O)ccc2c1
InChIInChI=1S/C23H17NO2/c1-26-16-8-10-17-15(12-16)7-11-21(25)22(17)20-13-24-23-18-5-3-2-4-14(18)6-9-19(20)23/h2-13,24-25H,1H3
InChIKeyGKYVLHXLEQWHLP-UHFFFAOYSA-N
XLogP5.86
TPSA45.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500339.39
LogP ≤ 55.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(1H-benzo[g]indol-3-yl)-6-methoxynaphthalen-2-ol?
The IUPAC name of 1-(1H-benzo[g]indol-3-yl)-6-methoxynaphthalen-2-ol (CID 142739888) is 1-(1H-benzo[g]indol-3-yl)-6-methoxynaphthalen-2-ol.
What is the SMILES notation for 1-(1H-benzo[g]indol-3-yl)-6-methoxynaphthalen-2-ol?
The canonical SMILES for 1-(1H-benzo[g]indol-3-yl)-6-methoxynaphthalen-2-ol is COc1ccc2c(-c3c[nH]c4c3ccc3ccccc34)c(O)ccc2c1.
What is the InChIKey of 1-(1H-benzo[g]indol-3-yl)-6-methoxynaphthalen-2-ol?
The InChIKey is GKYVLHXLEQWHLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H17NO2/c1-26-16-8-10-17-15(12-16)7-11-21(25)22(17)20-13-24-23-18-5-3-2-4-14(18)6-9-19(20)23/h2-13,24-25H,1H3.
What are the key properties of 1-(1H-benzo[g]indol-3-yl)-6-methoxynaphthalen-2-ol?
1-(1H-benzo[g]indol-3-yl)-6-methoxynaphthalen-2-ol has a molecular weight of 339.39 g/mol, XLogP of 5.86, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1H-benzo[g]indol-3-yl)-6-methoxynaphthalen-2-ol is sourced from PubChem (CID 142739888), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).