(4-hydroxyphenyl)-[2-(3-methoxyphenyl)naphthalen-1-yl]methanone

C24H18O3 — CID 19362229

IUPAC(4-hydroxyphenyl)-[2-(3-methoxyphenyl)naphthalen-1-yl]methanone
SMILESCOc1cccc(-c2ccc3ccccc3c2C(=O)c2ccc(O)cc2)c1
InChIInChI=1S/C24H18O3/c1-27-20-7-4-6-18(15-20)22-14-11-16-5-2-3-8-21(16)23(22)24(26)17-9-12-19(25)13-10-17/h2-15,25H,1H3
InChIKeyARMHCWZORMQFQI-UHFFFAOYSA-N
MW354.41 g/mol
LogP5.45
Rot. Bonds4

About (4-hydroxyphenyl)-[2-(3-methoxyphenyl)naphthalen-1-yl]methanone

(4-hydroxyphenyl)-[2-(3-methoxyphenyl)naphthalen-1-yl]methanone (PubChem CID 19362229) has the molecular formula C24H18O3 and a molecular weight of 354.41 g/mol. Its IUPAC name is (4-hydroxyphenyl)-[2-(3-methoxyphenyl)naphthalen-1-yl]methanone.

Molecular Properties

Compound Name(4-hydroxyphenyl)-[2-(3-methoxyphenyl)naphthalen-1-yl]methanone
PubChem CID19362229
Molecular FormulaC24H18O3
Molecular Weight354.41 g/mol
Exact Mass354.13
IUPAC Name(4-hydroxyphenyl)-[2-(3-methoxyphenyl)naphthalen-1-yl]methanone
SMILESCOc1cccc(-c2ccc3ccccc3c2C(=O)c2ccc(O)cc2)c1
InChIInChI=1S/C24H18O3/c1-27-20-7-4-6-18(15-20)22-14-11-16-5-2-3-8-21(16)23(22)24(26)17-9-12-19(25)13-10-17/h2-15,25H,1H3
InChIKeyARMHCWZORMQFQI-UHFFFAOYSA-N
XLogP5.45
TPSA46.53 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500354.41
LogP ≤ 55.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (4-hydroxyphenyl)-[2-(3-methoxyphenyl)naphthalen-1-yl]methanone?
The IUPAC name of (4-hydroxyphenyl)-[2-(3-methoxyphenyl)naphthalen-1-yl]methanone (CID 19362229) is (4-hydroxyphenyl)-[2-(3-methoxyphenyl)naphthalen-1-yl]methanone.
What is the SMILES notation for (4-hydroxyphenyl)-[2-(3-methoxyphenyl)naphthalen-1-yl]methanone?
The canonical SMILES for (4-hydroxyphenyl)-[2-(3-methoxyphenyl)naphthalen-1-yl]methanone is COc1cccc(-c2ccc3ccccc3c2C(=O)c2ccc(O)cc2)c1.
What is the InChIKey of (4-hydroxyphenyl)-[2-(3-methoxyphenyl)naphthalen-1-yl]methanone?
The InChIKey is ARMHCWZORMQFQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H18O3/c1-27-20-7-4-6-18(15-20)22-14-11-16-5-2-3-8-21(16)23(22)24(26)17-9-12-19(25)13-10-17/h2-15,25H,1H3.
What are the key properties of (4-hydroxyphenyl)-[2-(3-methoxyphenyl)naphthalen-1-yl]methanone?
(4-hydroxyphenyl)-[2-(3-methoxyphenyl)naphthalen-1-yl]methanone has a molecular weight of 354.41 g/mol, XLogP of 5.45, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-hydroxyphenyl)-[2-(3-methoxyphenyl)naphthalen-1-yl]methanone is sourced from PubChem (CID 19362229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).