2-[4,5-bis(trifluoromethyl)imidazol-3-id-2-yl]pyridine;iridium

C10H4F6IrN3- — CID 20807157

IUPAC2-[4,5-bis(trifluoromethyl)imidazol-3-id-2-yl]pyridine;iridium
SMILESFC(F)(F)c1nc(-c2ccccn2)[n-]c1C(F)(F)F.[Ir]
InChIInChI=1S/C10H4F6N3.Ir/c11-9(12,13)6-7(10(14,15)16)19-8(18-6)5-3-1-2-4-17-5;/h1-4H;/q-1;
InChIKeyYEWNRQHICVPOTQ-UHFFFAOYSA-N
MW472.37 g/mol
LogP3.14
Rot. Bonds1

About 2-[4,5-bis(trifluoromethyl)imidazol-3-id-2-yl]pyridine;iridium

2-[4,5-bis(trifluoromethyl)imidazol-3-id-2-yl]pyridine;iridium (PubChem CID 20807157) has the molecular formula C10H4F6IrN3- and a molecular weight of 472.37 g/mol. Its IUPAC name is 2-[4,5-bis(trifluoromethyl)imidazol-3-id-2-yl]pyridine;iridium.

Molecular Properties

Compound Name2-[4,5-bis(trifluoromethyl)imidazol-3-id-2-yl]pyridine;iridium
PubChem CID20807157
Molecular FormulaC10H4F6IrN3-
Molecular Weight472.37 g/mol
Exact Mass472.99
IUPAC Name2-[4,5-bis(trifluoromethyl)imidazol-3-id-2-yl]pyridine;iridium
SMILESFC(F)(F)c1nc(-c2ccccn2)[n-]c1C(F)(F)F.[Ir]
InChIInChI=1S/C10H4F6N3.Ir/c11-9(12,13)6-7(10(14,15)16)19-8(18-6)5-3-1-2-4-17-5;/h1-4H;/q-1;
InChIKeyYEWNRQHICVPOTQ-UHFFFAOYSA-N
XLogP3.14
TPSA39.88 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500472.37
LogP ≤ 53.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

Imidazo(1,5-a)pyridine
CID 274090
7-(Trifluoromethyl)-3-(6-(trifluoromethyl)pyridin-2-yl)imidazo[1,2-a]pyrimidine
CID 9945466
3-(Pyridin-2-yl)-7-(trifluoromethyl)imidazo[1,2-a]pyrimidine
CID 9921462
2-(2-Methylimidazol-1-ylmethyl)pyridine
CID 10313324
3-Cyanoimidazo(1,2-a)pyridine
CID 80330
2-Methylimidazo[1,2-a]pyridin-3-amine
CID 15533833
2-(Imidazo(1,2-a)pyridin-2-yl)acetonitrile
CID 593901
2-Methylimidazo[1,2-a]pyridine
CID 136742
2-{1-[(1-propyl-1H-imidazol-2-yl)methyl]pyrrolidin-2-yl}pyridine
CID 56749720
1-Methyl-2-(1-methylpyrrol-2-yl)benzimidazole
CID 828656
Imidazo(1,2-a)pyridine-3-acetonitrile
CID 87281
3-Methylimidazo(1,5-a)pyridine
CID 2969264

Frequently Asked Questions

What is the IUPAC name of 2-[4,5-bis(trifluoromethyl)imidazol-3-id-2-yl]pyridine;iridium?
The IUPAC name of 2-[4,5-bis(trifluoromethyl)imidazol-3-id-2-yl]pyridine;iridium (CID 20807157) is 2-[4,5-bis(trifluoromethyl)imidazol-3-id-2-yl]pyridine;iridium.
What is the SMILES notation for 2-[4,5-bis(trifluoromethyl)imidazol-3-id-2-yl]pyridine;iridium?
The canonical SMILES for 2-[4,5-bis(trifluoromethyl)imidazol-3-id-2-yl]pyridine;iridium is FC(F)(F)c1nc(-c2ccccn2)[n-]c1C(F)(F)F.[Ir].
What is the InChIKey of 2-[4,5-bis(trifluoromethyl)imidazol-3-id-2-yl]pyridine;iridium?
The InChIKey is YEWNRQHICVPOTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H4F6N3.Ir/c11-9(12,13)6-7(10(14,15)16)19-8(18-6)5-3-1-2-4-17-5;/h1-4H;/q-1;.
What are the key properties of 2-[4,5-bis(trifluoromethyl)imidazol-3-id-2-yl]pyridine;iridium?
2-[4,5-bis(trifluoromethyl)imidazol-3-id-2-yl]pyridine;iridium has a molecular weight of 472.37 g/mol, XLogP of 3.14, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4,5-bis(trifluoromethyl)imidazol-3-id-2-yl]pyridine;iridium is sourced from PubChem (CID 20807157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).