9,9-dimethyl-8-(3-methyl-2H-imidazol-1-yl)indeno[2,1-c]pyridine

C18H19N3 — CID 140877669

IUPAC9,9-dimethyl-8-(3-methyl-2H-imidazol-1-yl)indeno[2,1-c]pyridine
SMILESCN1C=CN(c2cccc3c2C(C)(C)c2cnccc2-3)C1
InChIInChI=1S/C18H19N3/c1-18(2)15-11-19-8-7-13(15)14-5-4-6-16(17(14)18)21-10-9-20(3)12-21/h4-11H,12H2,1-3H3
InChIKeyUAXFITUPIOIDLP-UHFFFAOYSA-N
MW277.37 g/mol
LogP3.57
Rot. Bonds1

About 9,9-dimethyl-8-(3-methyl-2H-imidazol-1-yl)indeno[2,1-c]pyridine

9,9-dimethyl-8-(3-methyl-2H-imidazol-1-yl)indeno[2,1-c]pyridine (PubChem CID 140877669) has the molecular formula C18H19N3 and a molecular weight of 277.37 g/mol. Its IUPAC name is 9,9-dimethyl-8-(3-methyl-2H-imidazol-1-yl)indeno[2,1-c]pyridine.

Molecular Properties

Compound Name9,9-dimethyl-8-(3-methyl-2H-imidazol-1-yl)indeno[2,1-c]pyridine
PubChem CID140877669
Molecular FormulaC18H19N3
Molecular Weight277.37 g/mol
Exact Mass277.16
IUPAC Name9,9-dimethyl-8-(3-methyl-2H-imidazol-1-yl)indeno[2,1-c]pyridine
SMILESCN1C=CN(c2cccc3c2C(C)(C)c2cnccc2-3)C1
InChIInChI=1S/C18H19N3/c1-18(2)15-11-19-8-7-13(15)14-5-4-6-16(17(14)18)21-10-9-20(3)12-21/h4-11H,12H2,1-3H3
InChIKeyUAXFITUPIOIDLP-UHFFFAOYSA-N
XLogP3.57
TPSA19.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 53.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 9,9-dimethyl-8-(3-methyl-2H-imidazol-1-yl)indeno[2,1-c]pyridine?
The IUPAC name of 9,9-dimethyl-8-(3-methyl-2H-imidazol-1-yl)indeno[2,1-c]pyridine (CID 140877669) is 9,9-dimethyl-8-(3-methyl-2H-imidazol-1-yl)indeno[2,1-c]pyridine.
What is the SMILES notation for 9,9-dimethyl-8-(3-methyl-2H-imidazol-1-yl)indeno[2,1-c]pyridine?
The canonical SMILES for 9,9-dimethyl-8-(3-methyl-2H-imidazol-1-yl)indeno[2,1-c]pyridine is CN1C=CN(c2cccc3c2C(C)(C)c2cnccc2-3)C1.
What is the InChIKey of 9,9-dimethyl-8-(3-methyl-2H-imidazol-1-yl)indeno[2,1-c]pyridine?
The InChIKey is UAXFITUPIOIDLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3/c1-18(2)15-11-19-8-7-13(15)14-5-4-6-16(17(14)18)21-10-9-20(3)12-21/h4-11H,12H2,1-3H3.
What are the key properties of 9,9-dimethyl-8-(3-methyl-2H-imidazol-1-yl)indeno[2,1-c]pyridine?
9,9-dimethyl-8-(3-methyl-2H-imidazol-1-yl)indeno[2,1-c]pyridine has a molecular weight of 277.37 g/mol, XLogP of 3.57, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9,9-dimethyl-8-(3-methyl-2H-imidazol-1-yl)indeno[2,1-c]pyridine is sourced from PubChem (CID 140877669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).