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

C23H20N4 — CID 10020909

IUPAC9-ethyl-3-(5-methyl-4-pyridin-2-yl-1H-imidazol-2-yl)carbazole
SMILESCCn1c2ccccc2c2cc(-c3nc(-c4ccccn4)c(C)[nH]3)ccc21
InChIInChI=1S/C23H20N4/c1-3-27-20-10-5-4-8-17(20)18-14-16(11-12-21(18)27)23-25-15(2)22(26-23)19-9-6-7-13-24-19/h4-14H,3H2,1-2H3,(H,25,26)
InChIKeyCHEAQHKAGNKJME-UHFFFAOYSA-N
MW352.44 g/mol
LogP5.57
Rot. Bonds3

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

9-ethyl-3-(5-methyl-4-pyridin-2-yl-1H-imidazol-2-yl)carbazole (PubChem CID 10020909) has the molecular formula C23H20N4 and a molecular weight of 352.44 g/mol. Its IUPAC name is 9-ethyl-3-(5-methyl-4-pyridin-2-yl-1H-imidazol-2-yl)carbazole.

Molecular Properties

Compound Name9-ethyl-3-(5-methyl-4-pyridin-2-yl-1H-imidazol-2-yl)carbazole
PubChem CID10020909
Molecular FormulaC23H20N4
Molecular Weight352.44 g/mol
Exact Mass352.17
IUPAC Name9-ethyl-3-(5-methyl-4-pyridin-2-yl-1H-imidazol-2-yl)carbazole
SMILESCCn1c2ccccc2c2cc(-c3nc(-c4ccccn4)c(C)[nH]3)ccc21
InChIInChI=1S/C23H20N4/c1-3-27-20-10-5-4-8-17(20)18-14-16(11-12-21(18)27)23-25-15(2)22(26-23)19-9-6-7-13-24-19/h4-14H,3H2,1-2H3,(H,25,26)
InChIKeyCHEAQHKAGNKJME-UHFFFAOYSA-N
XLogP5.57
TPSA46.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms27
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500352.44
LogP ≤ 55.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 9-ethyl-3-(5-methyl-4-pyridin-2-yl-1H-imidazol-2-yl)carbazole?
The IUPAC name of 9-ethyl-3-(5-methyl-4-pyridin-2-yl-1H-imidazol-2-yl)carbazole (CID 10020909) is 9-ethyl-3-(5-methyl-4-pyridin-2-yl-1H-imidazol-2-yl)carbazole.
What is the SMILES notation for 9-ethyl-3-(5-methyl-4-pyridin-2-yl-1H-imidazol-2-yl)carbazole?
The canonical SMILES for 9-ethyl-3-(5-methyl-4-pyridin-2-yl-1H-imidazol-2-yl)carbazole is CCn1c2ccccc2c2cc(-c3nc(-c4ccccn4)c(C)[nH]3)ccc21.
What is the InChIKey of 9-ethyl-3-(5-methyl-4-pyridin-2-yl-1H-imidazol-2-yl)carbazole?
The InChIKey is CHEAQHKAGNKJME-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20N4/c1-3-27-20-10-5-4-8-17(20)18-14-16(11-12-21(18)27)23-25-15(2)22(26-23)19-9-6-7-13-24-19/h4-14H,3H2,1-2H3,(H,25,26).
What are the key properties of 9-ethyl-3-(5-methyl-4-pyridin-2-yl-1H-imidazol-2-yl)carbazole?
9-ethyl-3-(5-methyl-4-pyridin-2-yl-1H-imidazol-2-yl)carbazole has a molecular weight of 352.44 g/mol, XLogP of 5.57, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-ethyl-3-(5-methyl-4-pyridin-2-yl-1H-imidazol-2-yl)carbazole is sourced from PubChem (CID 10020909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).