2-methyl-1-(2-methylphenyl)-5H-indeno[1,2-c]pyridin-2-ium

C20H18N+ — CID 59583170

IUPAC2-methyl-1-(2-methylphenyl)-5H-indeno[1,2-c]pyridin-2-ium
SMILESCc1ccccc1-c1c2c(cc[n+]1C)Cc1ccccc1-2
InChIInChI=1S/C20H18N/c1-14-7-3-5-9-17(14)20-19-16(11-12-21(20)2)13-15-8-4-6-10-18(15)19/h3-12H,13H2,1-2H3/q+1
InChIKeyFQKXOIVQVVTTAD-UHFFFAOYSA-N
MW272.37 g/mol
LogP4.06
Rot. Bonds1

About 2-methyl-1-(2-methylphenyl)-5H-indeno[1,2-c]pyridin-2-ium

2-methyl-1-(2-methylphenyl)-5H-indeno[1,2-c]pyridin-2-ium (PubChem CID 59583170) has the molecular formula C20H18N+ and a molecular weight of 272.37 g/mol. Its IUPAC name is 2-methyl-1-(2-methylphenyl)-5H-indeno[1,2-c]pyridin-2-ium.

Molecular Properties

Compound Name2-methyl-1-(2-methylphenyl)-5H-indeno[1,2-c]pyridin-2-ium
PubChem CID59583170
Molecular FormulaC20H18N+
Molecular Weight272.37 g/mol
Exact Mass272.14
IUPAC Name2-methyl-1-(2-methylphenyl)-5H-indeno[1,2-c]pyridin-2-ium
SMILESCc1ccccc1-c1c2c(cc[n+]1C)Cc1ccccc1-2
InChIInChI=1S/C20H18N/c1-14-7-3-5-9-17(14)20-19-16(11-12-21(20)2)13-15-8-4-6-10-18(15)19/h3-12H,13H2,1-2H3/q+1
InChIKeyFQKXOIVQVVTTAD-UHFFFAOYSA-N
XLogP4.06
TPSA3.88 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.37
LogP ≤ 54.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'quaternary_nitrogen_1', 'substructure': 'N/A'}

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Related Compounds

6,6-dideuterio-2-methyl-1-(2-methylphenyl)-5,7-dihydrocyclopenta[c]pyridin-2-ium
CID 140944399
4,5-dimethyl-9H-fluorene
CID 14389533
1,3,4,5-tetramethyl-2-(2-methylphenyl)pyridin-1-ium;1,3,4-trimethyl-2-(2-methylphenyl)pyridin-1-ium
CID 161077986
9H-fluoren-4-ylboronic acid
CID 68786516
ethene;9H-fluorene
CID 159544077
24-methyl-25-(2-methylphenyl)-27-thia-24-azoniahexacyclo[18.7.0.02,7.08,13.014,19.021,26]heptacosa-1(20),2,4,6,8,10,12,14,16,18,21(26),22,24-tridecaene
CID 168811563
2-methyl-1-(2-methylphenyl)-[1]benzofuro[3,2-c]pyridin-2-ium
CID 90880561
2,5-dimethyl-4-(2-methylphenyl)-[1,3]oxazolo[5,4-c]pyridin-5-ium
CID 123379683
ethane;1-methyl-2-(2-methyl-9H-fluoren-1-yl)pyridin-1-ium;1-methyl-2-(2-methylphenyl)pyridin-1-ium
CID 161214626
5-methyl-4-(2-methylphenyl)-1a,7b-dihydro-1H-cyclopropa[f]isoquinolin-5-ium
CID 162269712
2-[2-(9H-fluoren-4-yl)-6-methylphenoxy]ethanol
CID 151946123
1-methyl-2-(2-methylphenyl)-3-(2,4,6-trimethylphenyl)-6H-indeno[1,2-e]benzimidazol-1-ium
CID 160742656

Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-(2-methylphenyl)-5H-indeno[1,2-c]pyridin-2-ium?
The IUPAC name of 2-methyl-1-(2-methylphenyl)-5H-indeno[1,2-c]pyridin-2-ium (CID 59583170) is 2-methyl-1-(2-methylphenyl)-5H-indeno[1,2-c]pyridin-2-ium.
What is the SMILES notation for 2-methyl-1-(2-methylphenyl)-5H-indeno[1,2-c]pyridin-2-ium?
The canonical SMILES for 2-methyl-1-(2-methylphenyl)-5H-indeno[1,2-c]pyridin-2-ium is Cc1ccccc1-c1c2c(cc[n+]1C)Cc1ccccc1-2.
What is the InChIKey of 2-methyl-1-(2-methylphenyl)-5H-indeno[1,2-c]pyridin-2-ium?
The InChIKey is FQKXOIVQVVTTAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18N/c1-14-7-3-5-9-17(14)20-19-16(11-12-21(20)2)13-15-8-4-6-10-18(15)19/h3-12H,13H2,1-2H3/q+1.
What are the key properties of 2-methyl-1-(2-methylphenyl)-5H-indeno[1,2-c]pyridin-2-ium?
2-methyl-1-(2-methylphenyl)-5H-indeno[1,2-c]pyridin-2-ium has a molecular weight of 272.37 g/mol, XLogP of 4.06, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-(2-methylphenyl)-5H-indeno[1,2-c]pyridin-2-ium is sourced from PubChem (CID 59583170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).