4-(6-(131I)iodoimidazo[1,2-a]pyridin-2-yl)-N,N-dimethyl(131I)aniline

C15H14IN3 — CID 72720802

IUPAC4-(6-(131I)iodoimidazo[1,2-a]pyridin-2-yl)-N,N-dimethyl(131I)aniline
SMILESCN(C)c1ccc(-c2cn3cc([131I])ccc3n2)cc1
InChIInChI=1S/C15H14IN3/c1-18(2)13-6-3-11(4-7-13)14-10-19-9-12(16)5-8-15(19)17-14/h3-10H,1-2H3/i16+4
InChIKeyGUJHUHNUHJMRII-SZTGYKDWSA-N
MW367.20 g/mol
LogP3.67
Rot. Bonds2

About 4-(6-(131I)iodoimidazo[1,2-a]pyridin-2-yl)-N,N-dimethyl(131I)aniline

4-(6-(131I)iodoimidazo[1,2-a]pyridin-2-yl)-N,N-dimethyl(131I)aniline (PubChem CID 72720802) has the molecular formula C15H14IN3 and a molecular weight of 367.20 g/mol. Its IUPAC name is 4-(6-(131I)iodoimidazo[1,2-a]pyridin-2-yl)-N,N-dimethyl(131I)aniline.

Molecular Properties

Compound Name4-(6-(131I)iodoimidazo[1,2-a]pyridin-2-yl)-N,N-dimethyl(131I)aniline
PubChem CID72720802
Molecular FormulaC15H14IN3
Molecular Weight367.20 g/mol
Exact Mass367.02
IUPAC Name4-(6-(131I)iodoimidazo[1,2-a]pyridin-2-yl)-N,N-dimethyl(131I)aniline
SMILESCN(C)c1ccc(-c2cn3cc([131I])ccc3n2)cc1
InChIInChI=1S/C15H14IN3/c1-18(2)13-6-3-11(4-7-13)14-10-19-9-12(16)5-8-15(19)17-14/h3-10H,1-2H3/i16+4
InChIKeyGUJHUHNUHJMRII-SZTGYKDWSA-N
XLogP3.67
TPSA20.54 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.20
LogP ≤ 53.67
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

2-[4-(6-(131I)iodoimidazo[1,2-a]pyridin-2-yl)phenoxy]ethanol
CID 24880820
4-[6-[2-[2-(2-fluoroethoxy)ethoxy]ethoxy]imidazo[1,2-a]pyridin-2-yl]-N,N-dimethylaniline
CID 87627962
4-(dimethylamino)-N-[4-(6-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide
CID 45137441
4-(6-bromoimidazo[1,2-a]pyridin-2-yl)-N,N-diethylaniline
CID 24994440
2-(4-bromophenyl)-N,N-dimethylimidazo[1,2-a]pyridin-7-amine
CID 165371576
[2-(4-methylphenyl)imidazo[1,2-a]pyridin-6-yl]methanol
CID 14155694
ethane;4-(6-methylimidazo[1,2-a]pyridin-2-yl)phenol
CID 143799480
2-(4-methylphenyl)-6-methylsulfanylimidazo[1,2-a]pyridine
CID 15179822
5-(6-fluoroimidazo[1,2-a]pyridin-2-yl)-N,N-dimethylpyridin-2-amine
CID 59800676
2-(4-tert-butylphenyl)-6-iodoimidazo[1,2-a]pyridine
CID 10571546
[4-(6-methylimidazo[1,2-a]pyridin-2-yl)phenyl]methanol
CID 54382865
4-[(1E,3E)-4-[2-(4-methoxyphenyl)imidazo[1,2-a]pyridin-7-yl]buta-1,3-dienyl]-N,N-dimethylaniline
CID 156698980

Frequently Asked Questions

What is the IUPAC name of 4-(6-(131I)iodoimidazo[1,2-a]pyridin-2-yl)-N,N-dimethyl(131I)aniline?
The IUPAC name of 4-(6-(131I)iodoimidazo[1,2-a]pyridin-2-yl)-N,N-dimethyl(131I)aniline (CID 72720802) is 4-(6-(131I)iodoimidazo[1,2-a]pyridin-2-yl)-N,N-dimethyl(131I)aniline.
What is the SMILES notation for 4-(6-(131I)iodoimidazo[1,2-a]pyridin-2-yl)-N,N-dimethyl(131I)aniline?
The canonical SMILES for 4-(6-(131I)iodoimidazo[1,2-a]pyridin-2-yl)-N,N-dimethyl(131I)aniline is CN(C)c1ccc(-c2cn3cc([131I])ccc3n2)cc1.
What is the InChIKey of 4-(6-(131I)iodoimidazo[1,2-a]pyridin-2-yl)-N,N-dimethyl(131I)aniline?
The InChIKey is GUJHUHNUHJMRII-SZTGYKDWSA-N. The full InChI is InChI=1S/C15H14IN3/c1-18(2)13-6-3-11(4-7-13)14-10-19-9-12(16)5-8-15(19)17-14/h3-10H,1-2H3/i16+4.
What are the key properties of 4-(6-(131I)iodoimidazo[1,2-a]pyridin-2-yl)-N,N-dimethyl(131I)aniline?
4-(6-(131I)iodoimidazo[1,2-a]pyridin-2-yl)-N,N-dimethyl(131I)aniline has a molecular weight of 367.20 g/mol, XLogP of 3.67, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(6-(131I)iodoimidazo[1,2-a]pyridin-2-yl)-N,N-dimethyl(131I)aniline is sourced from PubChem (CID 72720802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).