3-(4,5-dimethyl-1H-imidazol-2-yl)-9-ethylcarbazole

C19H19N3 — CID 10017062

IUPAC3-(4,5-dimethyl-1H-imidazol-2-yl)-9-ethylcarbazole
SMILESCCn1c2ccccc2c2cc(-c3nc(C)c(C)[nH]3)ccc21
InChIInChI=1S/C19H19N3/c1-4-22-17-8-6-5-7-15(17)16-11-14(9-10-18(16)22)19-20-12(2)13(3)21-19/h5-11H,4H2,1-3H3,(H,20,21)
InChIKeyQEAFDAIQRSTVCT-UHFFFAOYSA-N
MW289.38 g/mol
LogP4.82
Rot. Bonds2

About 3-(4,5-dimethyl-1H-imidazol-2-yl)-9-ethylcarbazole

3-(4,5-dimethyl-1H-imidazol-2-yl)-9-ethylcarbazole (PubChem CID 10017062) has the molecular formula C19H19N3 and a molecular weight of 289.38 g/mol. Its IUPAC name is 3-(4,5-dimethyl-1H-imidazol-2-yl)-9-ethylcarbazole.

Molecular Properties

Compound Name3-(4,5-dimethyl-1H-imidazol-2-yl)-9-ethylcarbazole
PubChem CID10017062
Molecular FormulaC19H19N3
Molecular Weight289.38 g/mol
Exact Mass289.16
IUPAC Name3-(4,5-dimethyl-1H-imidazol-2-yl)-9-ethylcarbazole
SMILESCCn1c2ccccc2c2cc(-c3nc(C)c(C)[nH]3)ccc21
InChIInChI=1S/C19H19N3/c1-4-22-17-8-6-5-7-15(17)16-11-14(9-10-18(16)22)19-20-12(2)13(3)21-19/h5-11H,4H2,1-3H3,(H,20,21)
InChIKeyQEAFDAIQRSTVCT-UHFFFAOYSA-N
XLogP4.82
TPSA33.61 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.38
LogP ≤ 54.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(4,5-dimethyl-1H-imidazol-2-yl)-9-ethylcarbazole?
The IUPAC name of 3-(4,5-dimethyl-1H-imidazol-2-yl)-9-ethylcarbazole (CID 10017062) is 3-(4,5-dimethyl-1H-imidazol-2-yl)-9-ethylcarbazole.
What is the SMILES notation for 3-(4,5-dimethyl-1H-imidazol-2-yl)-9-ethylcarbazole?
The canonical SMILES for 3-(4,5-dimethyl-1H-imidazol-2-yl)-9-ethylcarbazole is CCn1c2ccccc2c2cc(-c3nc(C)c(C)[nH]3)ccc21.
What is the InChIKey of 3-(4,5-dimethyl-1H-imidazol-2-yl)-9-ethylcarbazole?
The InChIKey is QEAFDAIQRSTVCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3/c1-4-22-17-8-6-5-7-15(17)16-11-14(9-10-18(16)22)19-20-12(2)13(3)21-19/h5-11H,4H2,1-3H3,(H,20,21).
What are the key properties of 3-(4,5-dimethyl-1H-imidazol-2-yl)-9-ethylcarbazole?
3-(4,5-dimethyl-1H-imidazol-2-yl)-9-ethylcarbazole has a molecular weight of 289.38 g/mol, XLogP of 4.82, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4,5-dimethyl-1H-imidazol-2-yl)-9-ethylcarbazole is sourced from PubChem (CID 10017062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).