(4-methoxyphenyl)-[5-(4-methoxyphenyl)-1H-imidazol-2-yl]methanone

C18H16N2O3 — CID 15425806

IUPAC(4-methoxyphenyl)-[5-(4-methoxyphenyl)-1H-imidazol-2-yl]methanone
SMILESCOc1ccc(C(=O)c2ncc(-c3ccc(OC)cc3)[nH]2)cc1
InChIInChI=1S/C18H16N2O3/c1-22-14-7-3-12(4-8-14)16-11-19-18(20-16)17(21)13-5-9-15(23-2)10-6-13/h3-11H,1-2H3,(H,19,20)
InChIKeyNTNZYQHPYCTYRQ-UHFFFAOYSA-N
MW308.34 g/mol
LogP3.32
Rot. Bonds5

About (4-methoxyphenyl)-[5-(4-methoxyphenyl)-1H-imidazol-2-yl]methanone

(4-methoxyphenyl)-[5-(4-methoxyphenyl)-1H-imidazol-2-yl]methanone (PubChem CID 15425806) has the molecular formula C18H16N2O3 and a molecular weight of 308.34 g/mol. Its IUPAC name is (4-methoxyphenyl)-[5-(4-methoxyphenyl)-1H-imidazol-2-yl]methanone.

Molecular Properties

Compound Name(4-methoxyphenyl)-[5-(4-methoxyphenyl)-1H-imidazol-2-yl]methanone
PubChem CID15425806
Molecular FormulaC18H16N2O3
Molecular Weight308.34 g/mol
Exact Mass308.12
IUPAC Name(4-methoxyphenyl)-[5-(4-methoxyphenyl)-1H-imidazol-2-yl]methanone
SMILESCOc1ccc(C(=O)c2ncc(-c3ccc(OC)cc3)[nH]2)cc1
InChIInChI=1S/C18H16N2O3/c1-22-14-7-3-12(4-8-14)16-11-19-18(20-16)17(21)13-5-9-15(23-2)10-6-13/h3-11H,1-2H3,(H,19,20)
InChIKeyNTNZYQHPYCTYRQ-UHFFFAOYSA-N
XLogP3.32
TPSA64.21 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.34
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (4-methoxyphenyl)-[5-(4-methoxyphenyl)-1H-imidazol-2-yl]methanone?
The IUPAC name of (4-methoxyphenyl)-[5-(4-methoxyphenyl)-1H-imidazol-2-yl]methanone (CID 15425806) is (4-methoxyphenyl)-[5-(4-methoxyphenyl)-1H-imidazol-2-yl]methanone.
What is the SMILES notation for (4-methoxyphenyl)-[5-(4-methoxyphenyl)-1H-imidazol-2-yl]methanone?
The canonical SMILES for (4-methoxyphenyl)-[5-(4-methoxyphenyl)-1H-imidazol-2-yl]methanone is COc1ccc(C(=O)c2ncc(-c3ccc(OC)cc3)[nH]2)cc1.
What is the InChIKey of (4-methoxyphenyl)-[5-(4-methoxyphenyl)-1H-imidazol-2-yl]methanone?
The InChIKey is NTNZYQHPYCTYRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N2O3/c1-22-14-7-3-12(4-8-14)16-11-19-18(20-16)17(21)13-5-9-15(23-2)10-6-13/h3-11H,1-2H3,(H,19,20).
What are the key properties of (4-methoxyphenyl)-[5-(4-methoxyphenyl)-1H-imidazol-2-yl]methanone?
(4-methoxyphenyl)-[5-(4-methoxyphenyl)-1H-imidazol-2-yl]methanone has a molecular weight of 308.34 g/mol, XLogP of 3.32, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methoxyphenyl)-[5-(4-methoxyphenyl)-1H-imidazol-2-yl]methanone is sourced from PubChem (CID 15425806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).