2-fluoro-7,8-dimethyl-1H-acenaphthyleno[1,2-d]imidazol-1-ide;iridium

Name: 2-fluoro-7,8-dimethyl-1H-acenaphthyleno[1,2-d]imidazol-1-ide;iridium — Molecular Data
Creator: MolForge
License: https://creativecommons.org/publicdomain/zero/1.0/

C₁₅H₁₀FIrN₂- — CID 59515042

Data last refreshed: 2026-04-15 (MolForge compound catalog, from PubChem)

IUPAC2-fluoro-7,8-dimethyl-1H-acenaphthyleno[1,2-d]imidazol-1-ide;iridium

SMILESCc1nc2c(n1C)-c1cccc3cc(F)[c-]c-2c13.[Ir]

InChIInChI=1S/C15H10FN2.Ir/c1-8-17-14-12-7-10(16)6-9-4-3-5-11(13(9)12)15(14)18(8)2;/h3-6H,1-2H3;/q-1;

InChIKeyBQEPRCNFBWMGIP-UHFFFAOYSA-N

MW429.47 g/mol

LogP3.47

Rot. Bonds

About 2-fluoro-7,8-dimethyl-1H-acenaphthyleno[1,2-d]imidazol-1-ide;iridium

2-fluoro-7,8-dimethyl-1H-acenaphthyleno[1,2-d]imidazol-1-ide;iridium (PubChem CID 59515042) has the molecular formula C₁₅H₁₀FIrN₂- and a molecular weight of 429.47 g/mol. Its IUPAC name is 2-fluoro-7,8-dimethyl-1H-acenaphthyleno[1,2-d]imidazol-1-ide;iridium.

Molecular Properties

Compound Name	2-fluoro-7,8-dimethyl-1H-acenaphthyleno[1,2-d]imidazol-1-ide;iridium
PubChem CID	59515042
Molecular Formula	C₁₅H₁₀FIrN₂-
Molecular Weight	429.47 g/mol
Exact Mass	430.05
IUPAC Name	2-fluoro-7,8-dimethyl-1H-acenaphthyleno[1,2-d]imidazol-1-ide;iridium
SMILES	Cc1nc2c(n1C)-c1cccc3cc(F)[c-]c-2c13.[Ir]
InChI	InChI=1S/C15H10FN2.Ir/c1-8-17-14-12-7-10(16)6-9-4-3-5-11(13(9)12)15(14)18(8)2;/h3-6H,1-2H3;/q-1;
InChIKey	BQEPRCNFBWMGIP-UHFFFAOYSA-N
XLogP	3.47
TPSA	17.82 Å²
H-Bond Donors
H-Bond Acceptors	2
Rotatable Bonds
Heavy Atoms	19
Complexity	—

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	429.47
LogP ≤ 5	3.47
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	2

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-7,8-dimethyl-1H-acenaphthyleno[1,2-d]imidazol-1-ide;iridium?

The IUPAC name of 2-fluoro-7,8-dimethyl-1H-acenaphthyleno[1,2-d]imidazol-1-ide;iridium (CID 59515042) is 2-fluoro-7,8-dimethyl-1H-acenaphthyleno[1,2-d]imidazol-1-ide;iridium.

What is the SMILES notation for 2-fluoro-7,8-dimethyl-1H-acenaphthyleno[1,2-d]imidazol-1-ide;iridium?

The canonical SMILES for 2-fluoro-7,8-dimethyl-1H-acenaphthyleno[1,2-d]imidazol-1-ide;iridium is Cc1nc2c(n1C)-c1cccc3cc(F)[c-]c-2c13.[Ir].

What is the InChIKey of 2-fluoro-7,8-dimethyl-1H-acenaphthyleno[1,2-d]imidazol-1-ide;iridium?

The InChIKey is BQEPRCNFBWMGIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10FN2.Ir/c1-8-17-14-12-7-10(16)6-9-4-3-5-11(13(9)12)15(14)18(8)2;/h3-6H,1-2H3;/q-1;.

What are the key properties of 2-fluoro-7,8-dimethyl-1H-acenaphthyleno[1,2-d]imidazol-1-ide;iridium?

2-fluoro-7,8-dimethyl-1H-acenaphthyleno[1,2-d]imidazol-1-ide;iridium has a molecular weight of 429.47 g/mol, XLogP of 3.47, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.

Where does this data come from?

All data for 2-fluoro-7,8-dimethyl-1H-acenaphthyleno[1,2-d]imidazol-1-ide;iridium is sourced from PubChem (CID 59515042), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

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Sources

PubChem CID 59515042 — identifiers, structure, computed properties (public domain)

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