2-(2-iodophenoxy)-2-phenylethanamine

C14H14INO — CID 55017639

IUPAC2-(2-iodophenoxy)-2-phenylethanamine
SMILESNCC(Oc1ccccc1I)c1ccccc1
InChIInChI=1S/C14H14INO/c15-12-8-4-5-9-13(12)17-14(10-16)11-6-2-1-3-7-11/h1-9,14H,10,16H2
InChIKeyQAMAODNCKDXCKN-UHFFFAOYSA-N
MW339.18 g/mol
LogP3.37
Rot. Bonds4

About 2-(2-iodophenoxy)-2-phenylethanamine

2-(2-iodophenoxy)-2-phenylethanamine (PubChem CID 55017639) has the molecular formula C14H14INO and a molecular weight of 339.18 g/mol. Its IUPAC name is 2-(2-iodophenoxy)-2-phenylethanamine.

Molecular Properties

Compound Name2-(2-iodophenoxy)-2-phenylethanamine
PubChem CID55017639
Molecular FormulaC14H14INO
Molecular Weight339.18 g/mol
Exact Mass339.01
IUPAC Name2-(2-iodophenoxy)-2-phenylethanamine
SMILESNCC(Oc1ccccc1I)c1ccccc1
InChIInChI=1S/C14H14INO/c15-12-8-4-5-9-13(12)17-14(10-16)11-6-2-1-3-7-11/h1-9,14H,10,16H2
InChIKeyQAMAODNCKDXCKN-UHFFFAOYSA-N
XLogP3.37
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.18
LogP ≤ 53.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-phenyl-2-(2-propan-2-ylphenoxy)ethanamine
CID 55017685
2-phenoxy-2-phenylethanamine chloride
CID 21228850
2-phenoxy-2-phenylethanamine;sulfane
CID 174620608
2-(2-methoxy-4-methylphenoxy)-2-phenylethanamine
CID 55017730
2-(2-chloro-5-methylphenoxy)-2-phenylethanamine
CID 55017590
2-(2-fluoro-5-methylphenoxy)-2-phenylethanamine
CID 64854414
2-(4-bromophenyl)-2-(2-methylsulfanylphenoxy)ethanamine
CID 63647284
4-(2-amino-1-phenylethoxy)benzonitrile
CID 55017587
2-(3-methoxyphenoxy)-2-phenylethanamine
CID 55017396
3-(2-amino-1-phenylethoxy)propan-1-amine
CID 70040020
2-[(2-methylpropan-2-yl)oxy]-2-phenylethanamine
CID 58172290
2-(2-fluoro-3-methylphenoxy)-2-(4-fluorophenyl)ethanamine
CID 107656314

Frequently Asked Questions

What is the IUPAC name of 2-(2-iodophenoxy)-2-phenylethanamine?
The IUPAC name of 2-(2-iodophenoxy)-2-phenylethanamine (CID 55017639) is 2-(2-iodophenoxy)-2-phenylethanamine.
What is the SMILES notation for 2-(2-iodophenoxy)-2-phenylethanamine?
The canonical SMILES for 2-(2-iodophenoxy)-2-phenylethanamine is NCC(Oc1ccccc1I)c1ccccc1.
What is the InChIKey of 2-(2-iodophenoxy)-2-phenylethanamine?
The InChIKey is QAMAODNCKDXCKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14INO/c15-12-8-4-5-9-13(12)17-14(10-16)11-6-2-1-3-7-11/h1-9,14H,10,16H2.
What are the key properties of 2-(2-iodophenoxy)-2-phenylethanamine?
2-(2-iodophenoxy)-2-phenylethanamine has a molecular weight of 339.18 g/mol, XLogP of 3.37, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-iodophenoxy)-2-phenylethanamine is sourced from PubChem (CID 55017639), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).