2-[3-(6-(125I)iodoimidazo[1,2-a]pyridin-2-yl)phenoxy]ethanol

C15H13IN2O2 — CID 24880884

IUPAC2-[3-(6-(125I)iodoimidazo[1,2-a]pyridin-2-yl)phenoxy]ethanol
SMILESOCCOc1cccc(-c2cn3cc([125I])ccc3n2)c1
InChIInChI=1S/C15H13IN2O2/c16-12-4-5-15-17-14(10-18(15)9-12)11-2-1-3-13(8-11)20-7-6-19/h1-5,8-10,19H,6-7H2/i16-2
InChIKeyNGYZMMMCTJXETD-RFLHHMENSA-N
MW378.19 g/mol
LogP2.98
Rot. Bonds4

About 2-[3-(6-(125I)iodoimidazo[1,2-a]pyridin-2-yl)phenoxy]ethanol

2-[3-(6-(125I)iodoimidazo[1,2-a]pyridin-2-yl)phenoxy]ethanol (PubChem CID 24880884) has the molecular formula C15H13IN2O2 and a molecular weight of 378.19 g/mol. Its IUPAC name is 2-[3-(6-(125I)iodoimidazo[1,2-a]pyridin-2-yl)phenoxy]ethanol.

Molecular Properties

Compound Name2-[3-(6-(125I)iodoimidazo[1,2-a]pyridin-2-yl)phenoxy]ethanol
PubChem CID24880884
Molecular FormulaC15H13IN2O2
Molecular Weight378.19 g/mol
Exact Mass378.00
IUPAC Name2-[3-(6-(125I)iodoimidazo[1,2-a]pyridin-2-yl)phenoxy]ethanol
SMILESOCCOc1cccc(-c2cn3cc([125I])ccc3n2)c1
InChIInChI=1S/C15H13IN2O2/c16-12-4-5-15-17-14(10-18(15)9-12)11-2-1-3-13(8-11)20-7-6-19/h1-5,8-10,19H,6-7H2/i16-2
InChIKeyNGYZMMMCTJXETD-RFLHHMENSA-N
XLogP2.98
TPSA46.76 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.19
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-[4-(6-(131I)iodoimidazo[1,2-a]pyridin-2-yl)phenoxy]ethanol
CID 24880820
3-[4-(6-(123I)iodoimidazo[1,2-a]pyridin-2-yl)phenoxy]propan-1-ol
CID 24880821
[3-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]phenyl] acetate
CID 162535130
2-(3-methoxyphenyl)imidazo[1,2-a]pyridine-6-carbonitrile
CID 82060343
6-bromo-2-[3-(difluoromethoxy)phenyl]imidazo[1,2-a]pyridine
CID 115403562
6-bromo-2-(3-methoxyphenyl)imidazo[1,2-a]pyrazine
CID 86660860
2-[2-[3-[3-[2-(2-hydroxyethoxy)ethoxy]phenyl]phenoxy]ethoxy]ethanol
CID 102155693
3-[6-(aminomethyl)imidazo[1,2-a]pyridin-2-yl]phenol
CID 117130711
[2-(3,4-difluorophenyl)imidazo[1,2-a]pyridin-6-yl]methanol
CID 82356992
2-(3-methoxyphenyl)-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)imidazo[1,2-a]pyridine
CID 67265133
2-[3-(aminomethyl)phenoxy]ethanol
CID 21465373
1-(2-hydroxyethyl)-3-[3-(6-iodoimidazo[1,2-a]pyridin-2-yl)anilino]pyrrole-2,5-dione
CID 168557338

Frequently Asked Questions

What is the IUPAC name of 2-[3-(6-(125I)iodoimidazo[1,2-a]pyridin-2-yl)phenoxy]ethanol?
The IUPAC name of 2-[3-(6-(125I)iodoimidazo[1,2-a]pyridin-2-yl)phenoxy]ethanol (CID 24880884) is 2-[3-(6-(125I)iodoimidazo[1,2-a]pyridin-2-yl)phenoxy]ethanol.
What is the SMILES notation for 2-[3-(6-(125I)iodoimidazo[1,2-a]pyridin-2-yl)phenoxy]ethanol?
The canonical SMILES for 2-[3-(6-(125I)iodoimidazo[1,2-a]pyridin-2-yl)phenoxy]ethanol is OCCOc1cccc(-c2cn3cc([125I])ccc3n2)c1.
What is the InChIKey of 2-[3-(6-(125I)iodoimidazo[1,2-a]pyridin-2-yl)phenoxy]ethanol?
The InChIKey is NGYZMMMCTJXETD-RFLHHMENSA-N. The full InChI is InChI=1S/C15H13IN2O2/c16-12-4-5-15-17-14(10-18(15)9-12)11-2-1-3-13(8-11)20-7-6-19/h1-5,8-10,19H,6-7H2/i16-2.
What are the key properties of 2-[3-(6-(125I)iodoimidazo[1,2-a]pyridin-2-yl)phenoxy]ethanol?
2-[3-(6-(125I)iodoimidazo[1,2-a]pyridin-2-yl)phenoxy]ethanol has a molecular weight of 378.19 g/mol, XLogP of 2.98, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(6-(125I)iodoimidazo[1,2-a]pyridin-2-yl)phenoxy]ethanol is sourced from PubChem (CID 24880884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).