2,5-dimethyl-10H-indolo[3,2-b]quinolin-5-ium;ethane

C19H21N2+ — CID 177360716

IUPAC2,5-dimethyl-10H-indolo[3,2-b]quinolin-5-ium;ethane
SMILESCC.Cc1ccc2c(c1)cc1[nH]c3ccccc3c1[n+]2C
InChIInChI=1S/C17H14N2.C2H6/c1-11-7-8-16-12(9-11)10-15-17(19(16)2)13-5-3-4-6-14(13)18-15;1-2/h3-10H,1-2H3;1-2H3/p+1
InChIKeyZWGHYZUGOVYFLG-UHFFFAOYSA-O
MW277.39 g/mol
LogP4.63
Rot. Bonds

About 2,5-dimethyl-10H-indolo[3,2-b]quinolin-5-ium;ethane

2,5-dimethyl-10H-indolo[3,2-b]quinolin-5-ium;ethane (PubChem CID 177360716) has the molecular formula C19H21N2+ and a molecular weight of 277.39 g/mol. Its IUPAC name is 2,5-dimethyl-10H-indolo[3,2-b]quinolin-5-ium;ethane.

Molecular Properties

Compound Name2,5-dimethyl-10H-indolo[3,2-b]quinolin-5-ium;ethane
PubChem CID177360716
Molecular FormulaC19H21N2+
Molecular Weight277.39 g/mol
Exact Mass277.17
IUPAC Name2,5-dimethyl-10H-indolo[3,2-b]quinolin-5-ium;ethane
SMILESCC.Cc1ccc2c(c1)cc1[nH]c3ccccc3c1[n+]2C
InChIInChI=1S/C17H14N2.C2H6/c1-11-7-8-16-12(9-11)10-15-17(19(16)2)13-5-3-4-6-14(13)18-15;1-2/h3-10H,1-2H3;1-2H3/p+1
InChIKeyZWGHYZUGOVYFLG-UHFFFAOYSA-O
XLogP4.63
TPSA19.67 Ų
H-Bond Donors1
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.39
LogP ≤ 54.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het_pyridiniums_A(39)', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_1', 'substructure': 'N/A'}

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Related Compounds

8-methyl-5H-benzo[b]carbazole
CID 154982200
2,10-dimethylacridin-10-ium
CID 25896
7-chloro-5-methyl-10H-indolo[3,2-b]quinolin-5-ium iodide
CID 53325746
hydrogen sulfate;5-methyl-3-nitro-10H-indolo[3,2-b]quinolin-5-ium
CID 10317326
5,11-dimethyl-10H-indolo[3,2-b]quinolin-5-ium iodide
CID 71681954
2,5-dimethyl-10-(4-methylphenyl)sulfonylindolo[3,2-b]quinolin-5-ium chloride
CID 177360736
bis(9H-carbazole);ethane
CID 145072085
9H-carbazole;ethane
CID 91098062
2-bromo-5-[5-(2-bromo-10H-indolo[3,2-b]quinolin-5-ium-5-yl)pentyl]-10H-indolo[3,2-b]quinolin-5-ium
CID 58985814
5-methyl-10H-indolo[3,2-b]quinolin-5-ium-11-amine
CID 67597321
2-fluoro-11-iodo-5-methyl-10H-indolo[3,2-b]quinolin-5-ium
CID 10649164
8-methyl-5H-phenanthridin-6-one
CID 102200304

Frequently Asked Questions

What is the IUPAC name of 2,5-dimethyl-10H-indolo[3,2-b]quinolin-5-ium;ethane?
The IUPAC name of 2,5-dimethyl-10H-indolo[3,2-b]quinolin-5-ium;ethane (CID 177360716) is 2,5-dimethyl-10H-indolo[3,2-b]quinolin-5-ium;ethane.
What is the SMILES notation for 2,5-dimethyl-10H-indolo[3,2-b]quinolin-5-ium;ethane?
The canonical SMILES for 2,5-dimethyl-10H-indolo[3,2-b]quinolin-5-ium;ethane is CC.Cc1ccc2c(c1)cc1[nH]c3ccccc3c1[n+]2C.
What is the InChIKey of 2,5-dimethyl-10H-indolo[3,2-b]quinolin-5-ium;ethane?
The InChIKey is ZWGHYZUGOVYFLG-UHFFFAOYSA-O. The full InChI is InChI=1S/C17H14N2.C2H6/c1-11-7-8-16-12(9-11)10-15-17(19(16)2)13-5-3-4-6-14(13)18-15;1-2/h3-10H,1-2H3;1-2H3/p+1.
What are the key properties of 2,5-dimethyl-10H-indolo[3,2-b]quinolin-5-ium;ethane?
2,5-dimethyl-10H-indolo[3,2-b]quinolin-5-ium;ethane has a molecular weight of 277.39 g/mol, XLogP of 4.63, 0 rotatable bonds, 1 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dimethyl-10H-indolo[3,2-b]quinolin-5-ium;ethane is sourced from PubChem (CID 177360716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).