3-(2-carbazol-9-ylpropan-2-yl)imidazo[1,2-f]phenanthridine

C30H23N3 — CID 58162790

IUPAC3-(2-carbazol-9-ylpropan-2-yl)imidazo[1,2-f]phenanthridine
SMILESCC(C)(c1cnc2c3ccccc3c3ccccc3n12)n1c2ccccc2c2ccccc21
InChIInChI=1S/C30H23N3/c1-30(2,33-26-17-9-6-13-22(26)23-14-7-10-18-27(23)33)28-19-31-29-24-15-4-3-11-20(24)21-12-5-8-16-25(21)32(28)29/h3-19H,1-2H3
InChIKeyQANANJHSEYLKMD-UHFFFAOYSA-N
MW425.54 g/mol
LogP7.53
Rot. Bonds2

About 3-(2-carbazol-9-ylpropan-2-yl)imidazo[1,2-f]phenanthridine

3-(2-carbazol-9-ylpropan-2-yl)imidazo[1,2-f]phenanthridine (PubChem CID 58162790) has the molecular formula C30H23N3 and a molecular weight of 425.54 g/mol. Its IUPAC name is 3-(2-carbazol-9-ylpropan-2-yl)imidazo[1,2-f]phenanthridine.

Molecular Properties

Compound Name3-(2-carbazol-9-ylpropan-2-yl)imidazo[1,2-f]phenanthridine
PubChem CID58162790
Molecular FormulaC30H23N3
Molecular Weight425.54 g/mol
Exact Mass425.19
IUPAC Name3-(2-carbazol-9-ylpropan-2-yl)imidazo[1,2-f]phenanthridine
SMILESCC(C)(c1cnc2c3ccccc3c3ccccc3n12)n1c2ccccc2c2ccccc21
InChIInChI=1S/C30H23N3/c1-30(2,33-26-17-9-6-13-22(26)23-14-7-10-18-27(23)33)28-19-31-29-24-15-4-3-11-20(24)21-12-5-8-16-25(21)32(28)29/h3-19H,1-2H3
InChIKeyQANANJHSEYLKMD-UHFFFAOYSA-N
XLogP7.53
TPSA22.23 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500425.54
LogP ≤ 57.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

carbanide;3-(2-carbazol-9-ylpropan-2-yl)-12H-imidazo[1,2-f]phenanthridin-12-ide;iridium;yttrium
CID 58162789
3-(2,3,4,5,6-pentamethylphenyl)imidazo[1,2-f]phenanthridine
CID 58162799
3,7-bis(2,2-dimethylpropyl)imidazo[1,2-f]phenanthridine
CID 58163115
3-tert-butyl-5,6-dimethylimidazo[2,1-a]isoquinoline
CID 58517636
3-[2-(2-deuterio-2-methylpropyl)-6-(2,3,3,3-tetradeuterio-2-methylpropyl)phenyl]imidazo[1,2-f]phenanthridine
CID 157249771
4-imidazo[1,2-f]phenanthridin-3-yl-N,N-diphenylaniline
CID 170530692
3-[4-(4-carbazol-9-yl-2-methylphenyl)-3-methylphenyl]imidazo[1,2-f]phenanthridine
CID 170530717
7-methyl-3-(2,3,4,5,6-pentamethylphenyl)imidazo[1,2-f]phenanthridine
CID 58163242
3-(2,6-dibromophenyl)-11-methoxyimidazo[1,2-f]phenanthridine
CID 70654518
3-(2-ethenyl-6-prop-1-en-2-ylphenyl)imidazo[1,2-f]phenanthridine
CID 91114421
19-methyl-14,16,18,21-tetrazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2,4,6,8,10,12,15,17,19-decaene
CID 46188509
9-(2,6-dimethylphenyl)-3-methylimidazo[1,2-f]phenanthridine
CID 59359175

Frequently Asked Questions

What is the IUPAC name of 3-(2-carbazol-9-ylpropan-2-yl)imidazo[1,2-f]phenanthridine?
The IUPAC name of 3-(2-carbazol-9-ylpropan-2-yl)imidazo[1,2-f]phenanthridine (CID 58162790) is 3-(2-carbazol-9-ylpropan-2-yl)imidazo[1,2-f]phenanthridine.
What is the SMILES notation for 3-(2-carbazol-9-ylpropan-2-yl)imidazo[1,2-f]phenanthridine?
The canonical SMILES for 3-(2-carbazol-9-ylpropan-2-yl)imidazo[1,2-f]phenanthridine is CC(C)(c1cnc2c3ccccc3c3ccccc3n12)n1c2ccccc2c2ccccc21.
What is the InChIKey of 3-(2-carbazol-9-ylpropan-2-yl)imidazo[1,2-f]phenanthridine?
The InChIKey is QANANJHSEYLKMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H23N3/c1-30(2,33-26-17-9-6-13-22(26)23-14-7-10-18-27(23)33)28-19-31-29-24-15-4-3-11-20(24)21-12-5-8-16-25(21)32(28)29/h3-19H,1-2H3.
What are the key properties of 3-(2-carbazol-9-ylpropan-2-yl)imidazo[1,2-f]phenanthridine?
3-(2-carbazol-9-ylpropan-2-yl)imidazo[1,2-f]phenanthridine has a molecular weight of 425.54 g/mol, XLogP of 7.53, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-carbazol-9-ylpropan-2-yl)imidazo[1,2-f]phenanthridine is sourced from PubChem (CID 58162790), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).