(3-methoxyphenyl)-(3-phenylnaphthalen-1-yl)methanone

C24H18O2 — CID 44542422

IUPAC(3-methoxyphenyl)-(3-phenylnaphthalen-1-yl)methanone
SMILESCOc1cccc(C(=O)c2cc(-c3ccccc3)cc3ccccc23)c1
InChIInChI=1S/C24H18O2/c1-26-21-12-7-11-19(15-21)24(25)23-16-20(17-8-3-2-4-9-17)14-18-10-5-6-13-22(18)23/h2-16H,1H3
InChIKeyLDCQWJSTUOFNAQ-UHFFFAOYSA-N
MW338.41 g/mol
LogP5.75
Rot. Bonds4

About (3-methoxyphenyl)-(3-phenylnaphthalen-1-yl)methanone

(3-methoxyphenyl)-(3-phenylnaphthalen-1-yl)methanone (PubChem CID 44542422) has the molecular formula C24H18O2 and a molecular weight of 338.41 g/mol. Its IUPAC name is (3-methoxyphenyl)-(3-phenylnaphthalen-1-yl)methanone.

Molecular Properties

Compound Name(3-methoxyphenyl)-(3-phenylnaphthalen-1-yl)methanone
PubChem CID44542422
Molecular FormulaC24H18O2
Molecular Weight338.41 g/mol
Exact Mass338.13
IUPAC Name(3-methoxyphenyl)-(3-phenylnaphthalen-1-yl)methanone
SMILESCOc1cccc(C(=O)c2cc(-c3ccccc3)cc3ccccc23)c1
InChIInChI=1S/C24H18O2/c1-26-21-12-7-11-19(15-21)24(25)23-16-20(17-8-3-2-4-9-17)14-18-10-5-6-13-22(18)23/h2-16H,1H3
InChIKeyLDCQWJSTUOFNAQ-UHFFFAOYSA-N
XLogP5.75
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500338.41
LogP ≤ 55.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(3-methoxynaphthalen-1-yl)-(4-phenylphenyl)methanone
CID 169324752
1-(3-methoxyphenyl)-2-naphthalen-1-ylethane-1,2-dione
CID 56956967
(3-methoxyphenyl)-(2-methylquinolin-4-yl)methanone
CID 105078324
sodium;(3-methoxyphenyl)-phenylmethanone;hydroxide
CID 18779399
(3-methoxyphenyl)-(2-phenyl-1-benzofuran-3-yl)methanone
CID 21435338
[2-hydroxy-5-[12-(3-methoxyphenyl)chrysen-6-yl]phenyl]-phenylmethanone
CID 138600690
(3-methoxyphenyl)-quinolin-4-ylmethanone
CID 86811128
[3-(4-nitrophenyl)naphthalen-1-yl]-phenylmethanone
CID 102418781
2-bromo-N-[2-(3-methoxybenzoyl)naphthalen-1-yl]acetamide
CID 59527675
2-methoxy-5-phenylbenzene-1,3-dicarboxylic acid
CID 117100492
3-(3-methoxyphenyl)-1-methylnaphthalene
CID 59399504
1-(3-methoxyphenyl)-2-naphthalen-2-ylethane-1,2-dione
CID 170457473

Frequently Asked Questions

What is the IUPAC name of (3-methoxyphenyl)-(3-phenylnaphthalen-1-yl)methanone?
The IUPAC name of (3-methoxyphenyl)-(3-phenylnaphthalen-1-yl)methanone (CID 44542422) is (3-methoxyphenyl)-(3-phenylnaphthalen-1-yl)methanone.
What is the SMILES notation for (3-methoxyphenyl)-(3-phenylnaphthalen-1-yl)methanone?
The canonical SMILES for (3-methoxyphenyl)-(3-phenylnaphthalen-1-yl)methanone is COc1cccc(C(=O)c2cc(-c3ccccc3)cc3ccccc23)c1.
What is the InChIKey of (3-methoxyphenyl)-(3-phenylnaphthalen-1-yl)methanone?
The InChIKey is LDCQWJSTUOFNAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H18O2/c1-26-21-12-7-11-19(15-21)24(25)23-16-20(17-8-3-2-4-9-17)14-18-10-5-6-13-22(18)23/h2-16H,1H3.
What are the key properties of (3-methoxyphenyl)-(3-phenylnaphthalen-1-yl)methanone?
(3-methoxyphenyl)-(3-phenylnaphthalen-1-yl)methanone has a molecular weight of 338.41 g/mol, XLogP of 5.75, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3-methoxyphenyl)-(3-phenylnaphthalen-1-yl)methanone is sourced from PubChem (CID 44542422), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).