imidazo[1,2-f]phenanthridin-2-yl(trimethyl)azanium

C18H18N3+ — CID 58162682

IUPACimidazo[1,2-f]phenanthridin-2-yl(trimethyl)azanium
SMILESC[N+](C)(C)c1cn2c3ccccc3c3ccccc3c2n1
InChIInChI=1S/C18H18N3/c1-21(2,3)17-12-20-16-11-7-6-9-14(16)13-8-4-5-10-15(13)18(20)19-17/h4-12H,1-3H3/q+1
InChIKeyBWVMBIYVPMXICV-UHFFFAOYSA-N
MW276.36 g/mol
LogP3.84
Rot. Bonds1

About imidazo[1,2-f]phenanthridin-2-yl(trimethyl)azanium

imidazo[1,2-f]phenanthridin-2-yl(trimethyl)azanium (PubChem CID 58162682) has the molecular formula C18H18N3+ and a molecular weight of 276.36 g/mol. Its IUPAC name is imidazo[1,2-f]phenanthridin-2-yl(trimethyl)azanium.

Molecular Properties

Compound Nameimidazo[1,2-f]phenanthridin-2-yl(trimethyl)azanium
PubChem CID58162682
Molecular FormulaC18H18N3+
Molecular Weight276.36 g/mol
Exact Mass276.15
IUPAC Nameimidazo[1,2-f]phenanthridin-2-yl(trimethyl)azanium
SMILESC[N+](C)(C)c1cn2c3ccccc3c3ccccc3c2n1
InChIInChI=1S/C18H18N3/c1-21(2,3)17-12-20-16-11-7-6-9-14(16)13-8-4-5-10-15(13)18(20)19-17/h4-12H,1-3H3/q+1
InChIKeyBWVMBIYVPMXICV-UHFFFAOYSA-N
XLogP3.84
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.36
LogP ≤ 53.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_2', 'substructure': 'N/A'}

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Related Compounds

2,11-diiodoimidazo[1,2-f]phenanthridine
CID 135172312
7-methyl-2-[2-(7-methylimidazo[1,2-f]phenanthridin-2-yl)ethyl]imidazo[1,2-f]phenanthridine
CID 58202783
2-phenylimidazo[1,2-f]phenanthridin-11-ol
CID 163435365
4-[2-(2,5,15-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(13),3,5,7,9,11,14,16-octaen-4-yl)ethyl]-2,5,15-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(13),3,5,7,9,11,14,16-octaene
CID 58202809
2-(2,4-dimethyl-6-pentylphenyl)imidazo[1,2-f]phenanthridine
CID 70882553
10-methyl-4-[2-(10-methyl-2,5,11-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),3,5,7(12),8,10,13,15-octaen-4-yl)ethyl]-2,5,11-triazatetracyclo[11.4.0.02,6.07,12]heptadeca-1(17),3,5,7(12),8,10,13,15-octaene
CID 140693827
2,5-bis(benzimidazolo[2,1-a]isoquinolin-5-yl)-1,3,4-oxadiazole
CID 90086769
2-(5-methylthiophen-2-yl)-7-phenylimidazo[1,2-f]phenanthridine
CID 59358620
ethane;9-methylcarbazole;triphenylene
CID 142356751
9-[4-carbazol-9-yl-6-[4,6-di(carbazol-9-yl)-1,3,5-triazin-2-yl]-1,3,5-triazin-2-yl]carbazole
CID 149013970
carbanide;iridium;2-methoxy-12H-imidazo[1,2-f]phenanthridin-12-ide;yttrium
CID 58162772
bis(8-azatetracyclo[6.6.1.02,7.011,15]pentadeca-1(15),2,4,6,9,11,13-heptaen-10-yl)-dimethylsilane
CID 59221951

Frequently Asked Questions

What is the IUPAC name of imidazo[1,2-f]phenanthridin-2-yl(trimethyl)azanium?
The IUPAC name of imidazo[1,2-f]phenanthridin-2-yl(trimethyl)azanium (CID 58162682) is imidazo[1,2-f]phenanthridin-2-yl(trimethyl)azanium.
What is the SMILES notation for imidazo[1,2-f]phenanthridin-2-yl(trimethyl)azanium?
The canonical SMILES for imidazo[1,2-f]phenanthridin-2-yl(trimethyl)azanium is C[N+](C)(C)c1cn2c3ccccc3c3ccccc3c2n1.
What is the InChIKey of imidazo[1,2-f]phenanthridin-2-yl(trimethyl)azanium?
The InChIKey is BWVMBIYVPMXICV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N3/c1-21(2,3)17-12-20-16-11-7-6-9-14(16)13-8-4-5-10-15(13)18(20)19-17/h4-12H,1-3H3/q+1.
What are the key properties of imidazo[1,2-f]phenanthridin-2-yl(trimethyl)azanium?
imidazo[1,2-f]phenanthridin-2-yl(trimethyl)azanium has a molecular weight of 276.36 g/mol, XLogP of 3.84, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for imidazo[1,2-f]phenanthridin-2-yl(trimethyl)azanium is sourced from PubChem (CID 58162682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).