1-(3-methyl-2H-imidazol-1-yl)-9-phenylcarbazole

C22H19N3 — CID 59844789

IUPAC1-(3-methyl-2H-imidazol-1-yl)-9-phenylcarbazole
SMILESCN1C=CN(c2cccc3c4ccccc4n(-c4ccccc4)c23)C1
InChIInChI=1S/C22H19N3/c1-23-14-15-24(16-23)21-13-7-11-19-18-10-5-6-12-20(18)25(22(19)21)17-8-3-2-4-9-17/h2-15H,16H2,1H3
InChIKeyQNJRADQBXXYTBC-UHFFFAOYSA-N
MW325.42 g/mol
LogP4.96
Rot. Bonds2

About 1-(3-methyl-2H-imidazol-1-yl)-9-phenylcarbazole

1-(3-methyl-2H-imidazol-1-yl)-9-phenylcarbazole (PubChem CID 59844789) has the molecular formula C22H19N3 and a molecular weight of 325.42 g/mol. Its IUPAC name is 1-(3-methyl-2H-imidazol-1-yl)-9-phenylcarbazole.

Molecular Properties

Compound Name1-(3-methyl-2H-imidazol-1-yl)-9-phenylcarbazole
PubChem CID59844789
Molecular FormulaC22H19N3
Molecular Weight325.42 g/mol
Exact Mass325.16
IUPAC Name1-(3-methyl-2H-imidazol-1-yl)-9-phenylcarbazole
SMILESCN1C=CN(c2cccc3c4ccccc4n(-c4ccccc4)c23)C1
InChIInChI=1S/C22H19N3/c1-23-14-15-24(16-23)21-13-7-11-19-18-10-5-6-12-20(18)25(22(19)21)17-8-3-2-4-9-17/h2-15H,16H2,1H3
InChIKeyQNJRADQBXXYTBC-UHFFFAOYSA-N
XLogP4.96
TPSA11.41 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.42
LogP ≤ 54.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(3-methyl-2H-imidazol-1-yl)-9-phenylcarbazole?
The IUPAC name of 1-(3-methyl-2H-imidazol-1-yl)-9-phenylcarbazole (CID 59844789) is 1-(3-methyl-2H-imidazol-1-yl)-9-phenylcarbazole.
What is the SMILES notation for 1-(3-methyl-2H-imidazol-1-yl)-9-phenylcarbazole?
The canonical SMILES for 1-(3-methyl-2H-imidazol-1-yl)-9-phenylcarbazole is CN1C=CN(c2cccc3c4ccccc4n(-c4ccccc4)c23)C1.
What is the InChIKey of 1-(3-methyl-2H-imidazol-1-yl)-9-phenylcarbazole?
The InChIKey is QNJRADQBXXYTBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19N3/c1-23-14-15-24(16-23)21-13-7-11-19-18-10-5-6-12-20(18)25(22(19)21)17-8-3-2-4-9-17/h2-15H,16H2,1H3.
What are the key properties of 1-(3-methyl-2H-imidazol-1-yl)-9-phenylcarbazole?
1-(3-methyl-2H-imidazol-1-yl)-9-phenylcarbazole has a molecular weight of 325.42 g/mol, XLogP of 4.96, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-methyl-2H-imidazol-1-yl)-9-phenylcarbazole is sourced from PubChem (CID 59844789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).