(2-iodophenyl)-(4-methoxyphenyl)methanone

C14H11IO2 — CID 43160499

IUPAC(2-iodophenyl)-(4-methoxyphenyl)methanone
SMILESCOc1ccc(C(=O)c2ccccc2I)cc1
InChIInChI=1S/C14H11IO2/c1-17-11-8-6-10(7-9-11)14(16)12-4-2-3-5-13(12)15/h2-9H,1H3
InChIKeyKUKQWJIQTBQWEN-UHFFFAOYSA-N
MW338.14 g/mol
LogP3.53
Rot. Bonds3

About (2-iodophenyl)-(4-methoxyphenyl)methanone

(2-iodophenyl)-(4-methoxyphenyl)methanone (PubChem CID 43160499) has the molecular formula C14H11IO2 and a molecular weight of 338.14 g/mol. Its IUPAC name is (2-iodophenyl)-(4-methoxyphenyl)methanone.

Molecular Properties

Compound Name(2-iodophenyl)-(4-methoxyphenyl)methanone
PubChem CID43160499
Molecular FormulaC14H11IO2
Molecular Weight338.14 g/mol
Exact Mass337.98
IUPAC Name(2-iodophenyl)-(4-methoxyphenyl)methanone
SMILESCOc1ccc(C(=O)c2ccccc2I)cc1
InChIInChI=1S/C14H11IO2/c1-17-11-8-6-10(7-9-11)14(16)12-4-2-3-5-13(12)15/h2-9H,1H3
InChIKeyKUKQWJIQTBQWEN-UHFFFAOYSA-N
XLogP3.53
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.14
LogP ≤ 53.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'iodine', 'substructure': 'N/A'}

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Related Compounds

(2-iodophenyl)-(6-methoxynaphthalen-2-yl)methanone
CID 63491327
2-(4-methoxybenzoyl)benzoyl chloride
CID 13352630
(2-iodophenyl)-(5-methoxy-3-pyridinyl)methanone
CID 115793494
(4-methoxyphenyl)-(2-propan-2-ylphenyl)methanone
CID 23404431
(2,5-dimethoxyphenyl)-(2-iodophenyl)methanone
CID 15888023
2-[2-(4-methoxybenzoyl)phenyl]acetic acid
CID 15621221
(2-iodophenyl)-(4-phenylphenyl)methanone
CID 43337741
(2-ethenylphenyl)-(4-methoxyphenyl)methanone
CID 134346906
1H-indol-7-yl-(4-methoxyphenyl)methanone
CID 141393759
2-benzoyl-N'-(4-methoxybenzoyl)benzohydrazide
CID 585519
2,2-dihydroxy-2-[2-(4-methoxybenzoyl)phenyl]acetic acid
CID 154168626
(4-methoxyphenyl)-[2-(thiophene-2-carbonyl)phenyl]methanone
CID 71619058

Frequently Asked Questions

What is the IUPAC name of (2-iodophenyl)-(4-methoxyphenyl)methanone?
The IUPAC name of (2-iodophenyl)-(4-methoxyphenyl)methanone (CID 43160499) is (2-iodophenyl)-(4-methoxyphenyl)methanone.
What is the SMILES notation for (2-iodophenyl)-(4-methoxyphenyl)methanone?
The canonical SMILES for (2-iodophenyl)-(4-methoxyphenyl)methanone is COc1ccc(C(=O)c2ccccc2I)cc1.
What is the InChIKey of (2-iodophenyl)-(4-methoxyphenyl)methanone?
The InChIKey is KUKQWJIQTBQWEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11IO2/c1-17-11-8-6-10(7-9-11)14(16)12-4-2-3-5-13(12)15/h2-9H,1H3.
What are the key properties of (2-iodophenyl)-(4-methoxyphenyl)methanone?
(2-iodophenyl)-(4-methoxyphenyl)methanone has a molecular weight of 338.14 g/mol, XLogP of 3.53, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-iodophenyl)-(4-methoxyphenyl)methanone is sourced from PubChem (CID 43160499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).