1-[(4-iodophenyl)methoxy]-3,5-dimethoxybenzene

C15H15IO3 — CID 65490326

IUPAC1-[(4-iodophenyl)methoxy]-3,5-dimethoxybenzene
SMILESCOc1cc(OC)cc(OCc2ccc(I)cc2)c1
InChIInChI=1S/C15H15IO3/c1-17-13-7-14(18-2)9-15(8-13)19-10-11-3-5-12(16)6-4-11/h3-9H,10H2,1-2H3
InChIKeyXHSLWCCFMYRTND-UHFFFAOYSA-N
MW370.19 g/mol
LogP3.89
Rot. Bonds5

About 1-[(4-iodophenyl)methoxy]-3,5-dimethoxybenzene

1-[(4-iodophenyl)methoxy]-3,5-dimethoxybenzene (PubChem CID 65490326) has the molecular formula C15H15IO3 and a molecular weight of 370.19 g/mol. Its IUPAC name is 1-[(4-iodophenyl)methoxy]-3,5-dimethoxybenzene.

Molecular Properties

Compound Name1-[(4-iodophenyl)methoxy]-3,5-dimethoxybenzene
PubChem CID65490326
Molecular FormulaC15H15IO3
Molecular Weight370.19 g/mol
Exact Mass370.01
IUPAC Name1-[(4-iodophenyl)methoxy]-3,5-dimethoxybenzene
SMILESCOc1cc(OC)cc(OCc2ccc(I)cc2)c1
InChIInChI=1S/C15H15IO3/c1-17-13-7-14(18-2)9-15(8-13)19-10-11-3-5-12(16)6-4-11/h3-9H,10H2,1-2H3
InChIKeyXHSLWCCFMYRTND-UHFFFAOYSA-N
XLogP3.89
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.19
LogP ≤ 53.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

3-[(4-iodophenyl)methoxy]-5-methoxybenzenecarboximidamide
CID 103567720
4-[(3,5-dimethoxyphenoxy)methyl]aniline
CID 43589819
4-[(3,5-dimethoxyphenoxy)methyl]benzonitrile
CID 7707174
4-[(3,5-dimethoxyphenoxy)methyl]benzoic acid
CID 43238029
4-[(4-iodophenoxy)methyl]-1,2-dimethoxybenzene
CID 61400160
2-[(4-iodophenyl)methoxy]-5-methoxyaniline
CID 65498773
1,3-dimethoxy-5-[(4-nitrophenyl)methoxy]benzene
CID 7707175
1-(chloromethyl)-2-[(4-iodophenyl)methoxy]-4-methoxybenzene
CID 65477833
3-methoxy-5-phenylmethoxyaniline
CID 12658785
1-iodo-4-[(3-methylphenoxy)methyl]benzene
CID 65490135
1-iodo-3,5-bis(phenylmethoxy)benzene
CID 15389195
3,5-bis[(3,5-dimethoxyphenyl)methoxy]phenol
CID 54586280

Frequently Asked Questions

What is the IUPAC name of 1-[(4-iodophenyl)methoxy]-3,5-dimethoxybenzene?
The IUPAC name of 1-[(4-iodophenyl)methoxy]-3,5-dimethoxybenzene (CID 65490326) is 1-[(4-iodophenyl)methoxy]-3,5-dimethoxybenzene.
What is the SMILES notation for 1-[(4-iodophenyl)methoxy]-3,5-dimethoxybenzene?
The canonical SMILES for 1-[(4-iodophenyl)methoxy]-3,5-dimethoxybenzene is COc1cc(OC)cc(OCc2ccc(I)cc2)c1.
What is the InChIKey of 1-[(4-iodophenyl)methoxy]-3,5-dimethoxybenzene?
The InChIKey is XHSLWCCFMYRTND-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15IO3/c1-17-13-7-14(18-2)9-15(8-13)19-10-11-3-5-12(16)6-4-11/h3-9H,10H2,1-2H3.
What are the key properties of 1-[(4-iodophenyl)methoxy]-3,5-dimethoxybenzene?
1-[(4-iodophenyl)methoxy]-3,5-dimethoxybenzene has a molecular weight of 370.19 g/mol, XLogP of 3.89, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(4-iodophenyl)methoxy]-3,5-dimethoxybenzene is sourced from PubChem (CID 65490326), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).