9-ethyl-3-(5-methyl-4-phenyl-1H-imidazol-2-yl)carbazole

C24H21N3 — CID 10450609

IUPAC9-ethyl-3-(5-methyl-4-phenyl-1H-imidazol-2-yl)carbazole
SMILESCCn1c2ccccc2c2cc(-c3nc(-c4ccccc4)c(C)[nH]3)ccc21
InChIInChI=1S/C24H21N3/c1-3-27-21-12-8-7-11-19(21)20-15-18(13-14-22(20)27)24-25-16(2)23(26-24)17-9-5-4-6-10-17/h4-15H,3H2,1-2H3,(H,25,26)
InChIKeyRNEASTBHQHQRDF-UHFFFAOYSA-N
MW351.45 g/mol
LogP6.18
Rot. Bonds3

About 9-ethyl-3-(5-methyl-4-phenyl-1H-imidazol-2-yl)carbazole

9-ethyl-3-(5-methyl-4-phenyl-1H-imidazol-2-yl)carbazole (PubChem CID 10450609) has the molecular formula C24H21N3 and a molecular weight of 351.45 g/mol. Its IUPAC name is 9-ethyl-3-(5-methyl-4-phenyl-1H-imidazol-2-yl)carbazole.

Molecular Properties

Compound Name9-ethyl-3-(5-methyl-4-phenyl-1H-imidazol-2-yl)carbazole
PubChem CID10450609
Molecular FormulaC24H21N3
Molecular Weight351.45 g/mol
Exact Mass351.17
IUPAC Name9-ethyl-3-(5-methyl-4-phenyl-1H-imidazol-2-yl)carbazole
SMILESCCn1c2ccccc2c2cc(-c3nc(-c4ccccc4)c(C)[nH]3)ccc21
InChIInChI=1S/C24H21N3/c1-3-27-21-12-8-7-11-19(21)20-15-18(13-14-22(20)27)24-25-16(2)23(26-24)17-9-5-4-6-10-17/h4-15H,3H2,1-2H3,(H,25,26)
InChIKeyRNEASTBHQHQRDF-UHFFFAOYSA-N
XLogP6.18
TPSA33.61 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500351.45
LogP ≤ 56.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 9-ethyl-3-(5-methyl-4-phenyl-1H-imidazol-2-yl)carbazole?
The IUPAC name of 9-ethyl-3-(5-methyl-4-phenyl-1H-imidazol-2-yl)carbazole (CID 10450609) is 9-ethyl-3-(5-methyl-4-phenyl-1H-imidazol-2-yl)carbazole.
What is the SMILES notation for 9-ethyl-3-(5-methyl-4-phenyl-1H-imidazol-2-yl)carbazole?
The canonical SMILES for 9-ethyl-3-(5-methyl-4-phenyl-1H-imidazol-2-yl)carbazole is CCn1c2ccccc2c2cc(-c3nc(-c4ccccc4)c(C)[nH]3)ccc21.
What is the InChIKey of 9-ethyl-3-(5-methyl-4-phenyl-1H-imidazol-2-yl)carbazole?
The InChIKey is RNEASTBHQHQRDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H21N3/c1-3-27-21-12-8-7-11-19(21)20-15-18(13-14-22(20)27)24-25-16(2)23(26-24)17-9-5-4-6-10-17/h4-15H,3H2,1-2H3,(H,25,26).
What are the key properties of 9-ethyl-3-(5-methyl-4-phenyl-1H-imidazol-2-yl)carbazole?
9-ethyl-3-(5-methyl-4-phenyl-1H-imidazol-2-yl)carbazole has a molecular weight of 351.45 g/mol, XLogP of 6.18, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-ethyl-3-(5-methyl-4-phenyl-1H-imidazol-2-yl)carbazole is sourced from PubChem (CID 10450609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).