9-methyl-3-[1-methyl-6-(1-methylpyridin-1-ium-2-yl)pyridin-1-ium-3-yl]carbazole

C25H23N3+2 — CID 58435192

IUPAC9-methyl-3-[1-methyl-6-(1-methylpyridin-1-ium-2-yl)pyridin-1-ium-3-yl]carbazole
SMILESCn1c2ccccc2c2cc(-c3ccc(-c4cccc[n+]4C)[n+](C)c3)ccc21
InChIInChI=1S/C25H23N3/c1-26-15-7-6-10-24(26)25-14-12-19(17-27(25)2)18-11-13-23-21(16-18)20-8-4-5-9-22(20)28(23)3/h4-17H,1-3H3/q+2
InChIKeyPEXRCWKNAHAIOK-UHFFFAOYSA-N
MW365.48 g/mol
LogP4.31
Rot. Bonds2

About 9-methyl-3-[1-methyl-6-(1-methylpyridin-1-ium-2-yl)pyridin-1-ium-3-yl]carbazole

9-methyl-3-[1-methyl-6-(1-methylpyridin-1-ium-2-yl)pyridin-1-ium-3-yl]carbazole (PubChem CID 58435192) has the molecular formula C25H23N3+2 and a molecular weight of 365.48 g/mol. Its IUPAC name is 9-methyl-3-[1-methyl-6-(1-methylpyridin-1-ium-2-yl)pyridin-1-ium-3-yl]carbazole.

Molecular Properties

Compound Name9-methyl-3-[1-methyl-6-(1-methylpyridin-1-ium-2-yl)pyridin-1-ium-3-yl]carbazole
PubChem CID58435192
Molecular FormulaC25H23N3+2
Molecular Weight365.48 g/mol
Exact Mass365.19
IUPAC Name9-methyl-3-[1-methyl-6-(1-methylpyridin-1-ium-2-yl)pyridin-1-ium-3-yl]carbazole
SMILESCn1c2ccccc2c2cc(-c3ccc(-c4cccc[n+]4C)[n+](C)c3)ccc21
InChIInChI=1S/C25H23N3/c1-26-15-7-6-10-24(26)25-14-12-19(17-27(25)2)18-11-13-23-21(16-18)20-8-4-5-9-22(20)28(23)3/h4-17H,1-3H3/q+2
InChIKeyPEXRCWKNAHAIOK-UHFFFAOYSA-N
XLogP4.31
TPSA12.69 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.48
LogP ≤ 54.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

ethane;9-methyl-3-(9-methylcarbazol-3-yl)carbazole
CID 158738351
9-methyl-3-(9-methylcarbazol-3-yl)-6-(4-phenylphenyl)carbazole
CID 134359342
9-methyl-3-(9-methylcarbazol-2-yl)-6-phenylcarbazole;9-methyl-3-(9-methylcarbazol-3-yl)-6-phenylcarbazole;9-methyl-3-(9-methylcarbazol-3-yl)-6-(4-phenylphenyl)carbazole
CID 157228450
10-methyl-2-phenylacridin-9-one
CID 18533849
9-methyl-2-[2-[4-methyl-3-(1-methylpyridin-1-ium-2-yl)phenyl]ethynyl]carbazole
CID 58435122
3-dibenzofuran-2-yl-9-methylcarbazole
CID 121307339
9-methyl-3-[3-[9-(9-methyl-6-phenylcarbazol-3-yl)carbazol-3-yl]carbazol-9-yl]-6-phenylcarbazole
CID 71232675
9-methyl-3-(3-phenylcarbazol-9-yl)carbazole
CID 118137351
N-methyl-4-(9-methylcarbazol-3-yl)-N-phenylaniline
CID 126632601
1-methyl-2-(1-methylpyridin-1-ium-2-yl)pyridin-1-ium dichloride
CID 69331009
ethane;bis(9-methylcarbazole)
CID 159710949
3-(2,4-dimethyl-1H-pyrrol-3-yl)-9-methylcarbazole
CID 149264238

Frequently Asked Questions

What is the IUPAC name of 9-methyl-3-[1-methyl-6-(1-methylpyridin-1-ium-2-yl)pyridin-1-ium-3-yl]carbazole?
The IUPAC name of 9-methyl-3-[1-methyl-6-(1-methylpyridin-1-ium-2-yl)pyridin-1-ium-3-yl]carbazole (CID 58435192) is 9-methyl-3-[1-methyl-6-(1-methylpyridin-1-ium-2-yl)pyridin-1-ium-3-yl]carbazole.
What is the SMILES notation for 9-methyl-3-[1-methyl-6-(1-methylpyridin-1-ium-2-yl)pyridin-1-ium-3-yl]carbazole?
The canonical SMILES for 9-methyl-3-[1-methyl-6-(1-methylpyridin-1-ium-2-yl)pyridin-1-ium-3-yl]carbazole is Cn1c2ccccc2c2cc(-c3ccc(-c4cccc[n+]4C)[n+](C)c3)ccc21.
What is the InChIKey of 9-methyl-3-[1-methyl-6-(1-methylpyridin-1-ium-2-yl)pyridin-1-ium-3-yl]carbazole?
The InChIKey is PEXRCWKNAHAIOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H23N3/c1-26-15-7-6-10-24(26)25-14-12-19(17-27(25)2)18-11-13-23-21(16-18)20-8-4-5-9-22(20)28(23)3/h4-17H,1-3H3/q+2.
What are the key properties of 9-methyl-3-[1-methyl-6-(1-methylpyridin-1-ium-2-yl)pyridin-1-ium-3-yl]carbazole?
9-methyl-3-[1-methyl-6-(1-methylpyridin-1-ium-2-yl)pyridin-1-ium-3-yl]carbazole has a molecular weight of 365.48 g/mol, XLogP of 4.31, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 9-methyl-3-[1-methyl-6-(1-methylpyridin-1-ium-2-yl)pyridin-1-ium-3-yl]carbazole is sourced from PubChem (CID 58435192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).