3-ethoxy-1-naphthalen-1-ylnaphthalen-2-ol

C22H18O2 — CID 151645059

IUPAC3-ethoxy-1-naphthalen-1-ylnaphthalen-2-ol
SMILESCCOc1cc2ccccc2c(-c2cccc3ccccc23)c1O
InChIInChI=1S/C22H18O2/c1-2-24-20-14-16-9-4-6-12-18(16)21(22(20)23)19-13-7-10-15-8-3-5-11-17(15)19/h3-14,23H,2H2,1H3
InChIKeyQTILAGPDHOQTEH-UHFFFAOYSA-N
MW314.38 g/mol
LogP5.76
Rot. Bonds3

About 3-ethoxy-1-naphthalen-1-ylnaphthalen-2-ol

3-ethoxy-1-naphthalen-1-ylnaphthalen-2-ol (PubChem CID 151645059) has the molecular formula C22H18O2 and a molecular weight of 314.38 g/mol. Its IUPAC name is 3-ethoxy-1-naphthalen-1-ylnaphthalen-2-ol.

Molecular Properties

Compound Name3-ethoxy-1-naphthalen-1-ylnaphthalen-2-ol
PubChem CID151645059
Molecular FormulaC22H18O2
Molecular Weight314.38 g/mol
Exact Mass314.13
IUPAC Name3-ethoxy-1-naphthalen-1-ylnaphthalen-2-ol
SMILESCCOc1cc2ccccc2c(-c2cccc3ccccc23)c1O
InChIInChI=1S/C22H18O2/c1-2-24-20-14-16-9-4-6-12-18(16)21(22(20)23)19-13-7-10-15-8-3-5-11-17(15)19/h3-14,23H,2H2,1H3
InChIKeyQTILAGPDHOQTEH-UHFFFAOYSA-N
XLogP5.76
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500314.38
LogP ≤ 55.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-naphthalen-1-yl-3-phenylnaphthalen-2-ol
CID 11982733
ethyl 3-[3-(3-ethoxy-3-oxopropoxy)-4-naphthalen-1-ylnaphthalen-2-yl]oxypropanoate
CID 175752420
3-hydroxy-4-naphthalen-1-ylnaphthalene-2-carboxylic acid
CID 178068775
2,3-dimethyl-1-naphthalen-1-ylnaphthalene
CID 54572329
1-(3-hydroxy-4-naphthalen-1-ylnaphthalen-2-yl)hexan-1-one
CID 139885546
2-ethoxy-1-naphthalen-1-yl-9H-fluorene
CID 91339111
lithium;1-ethoxynaphthalene;hydride
CID 174613942
1,10-dinaphthalen-1-ylanthracene
CID 58645117
4-ethoxynaphthalen-2-amine
CID 57115135
(10-naphthalen-1-ylanthracen-1-yl)boronic acid
CID 154381135
9-naphthalen-1-yl-10-(10-naphthalen-1-ylanthracen-9-yl)oxyanthracene
CID 90290732
2-(3-ethoxy-1-fluoronaphthalen-2-yl)ethyl carbamate
CID 174985462

Frequently Asked Questions

What is the IUPAC name of 3-ethoxy-1-naphthalen-1-ylnaphthalen-2-ol?
The IUPAC name of 3-ethoxy-1-naphthalen-1-ylnaphthalen-2-ol (CID 151645059) is 3-ethoxy-1-naphthalen-1-ylnaphthalen-2-ol.
What is the SMILES notation for 3-ethoxy-1-naphthalen-1-ylnaphthalen-2-ol?
The canonical SMILES for 3-ethoxy-1-naphthalen-1-ylnaphthalen-2-ol is CCOc1cc2ccccc2c(-c2cccc3ccccc23)c1O.
What is the InChIKey of 3-ethoxy-1-naphthalen-1-ylnaphthalen-2-ol?
The InChIKey is QTILAGPDHOQTEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H18O2/c1-2-24-20-14-16-9-4-6-12-18(16)21(22(20)23)19-13-7-10-15-8-3-5-11-17(15)19/h3-14,23H,2H2,1H3.
What are the key properties of 3-ethoxy-1-naphthalen-1-ylnaphthalen-2-ol?
3-ethoxy-1-naphthalen-1-ylnaphthalen-2-ol has a molecular weight of 314.38 g/mol, XLogP of 5.76, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethoxy-1-naphthalen-1-ylnaphthalen-2-ol is sourced from PubChem (CID 151645059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).