4-methyl-2-(5-methyl-3H-imidazo[4,5-c]pyridin-5-ium-2-yl)quinoline

C17H15N4+ — CID 15644518

IUPAC4-methyl-2-(5-methyl-3H-imidazo[4,5-c]pyridin-5-ium-2-yl)quinoline
SMILESCc1cc(-c2nc3cc[n+](C)cc3[nH]2)nc2ccccc12
InChIInChI=1S/C17H14N4/c1-11-9-15(18-13-6-4-3-5-12(11)13)17-19-14-7-8-21(2)10-16(14)20-17/h3-10H,1-2H3/p+1
InChIKeyZCSQCUFZDMQSCX-UHFFFAOYSA-O
MW275.33 g/mol
LogP2.91
Rot. Bonds1

About 4-methyl-2-(5-methyl-3H-imidazo[4,5-c]pyridin-5-ium-2-yl)quinoline

4-methyl-2-(5-methyl-3H-imidazo[4,5-c]pyridin-5-ium-2-yl)quinoline (PubChem CID 15644518) has the molecular formula C17H15N4+ and a molecular weight of 275.33 g/mol. Its IUPAC name is 4-methyl-2-(5-methyl-3H-imidazo[4,5-c]pyridin-5-ium-2-yl)quinoline.

Molecular Properties

Compound Name4-methyl-2-(5-methyl-3H-imidazo[4,5-c]pyridin-5-ium-2-yl)quinoline
PubChem CID15644518
Molecular FormulaC17H15N4+
Molecular Weight275.33 g/mol
Exact Mass275.13
IUPAC Name4-methyl-2-(5-methyl-3H-imidazo[4,5-c]pyridin-5-ium-2-yl)quinoline
SMILESCc1cc(-c2nc3cc[n+](C)cc3[nH]2)nc2ccccc12
InChIInChI=1S/C17H14N4/c1-11-9-15(18-13-6-4-3-5-12(11)13)17-19-14-7-8-21(2)10-16(14)20-17/h3-10H,1-2H3/p+1
InChIKeyZCSQCUFZDMQSCX-UHFFFAOYSA-O
XLogP2.91
TPSA45.45 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.33
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 4-methyl-2-(5-methyl-3H-imidazo[4,5-c]pyridin-5-ium-2-yl)quinoline with MolForge

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Related Compounds

5-methyl-2-(4-methyl-2-pyridinyl)-3H-imidazo[4,5-c]pyridin-5-ium
CID 15083163
6-ethyl-5-methyl-2-(4-methylquinolin-2-yl)-1H-pyrimidine-4-thione
CID 106478144
2-(1,6-dimethylpyridin-1-ium-3-yl)-5-methyl-3H-imidazo[4,5-c]pyridin-5-ium
CID 15083169
4,4-dimethyl-2-(4-methylquinolin-2-yl)-1H-imidazol-5-one
CID 106953433
4-methyl-2-(2,3,4,5-tetramethylphenyl)quinoline
CID 59348556
2-(5-methyl-1H-pyrazol-3-yl)-1H-benzimidazole
CID 135804529
2-(4-iodophenyl)-4-methylquinoline
CID 8966469
2-(2,5-dimethylthiophen-3-yl)-4-methylquinoline
CID 8966475
2-(4-methylquinolin-2-yl)benzenethiol
CID 136656831
2-(3,4-dimethylphenyl)-4-methylquinoline;hydrochloride
CID 47104793
4-methyl-2-(1H-pyrazol-4-yl)quinoline
CID 170518667
2-(4,6-diphenyl-2-pyridinyl)-1H-benzimidazole
CID 4268760

Frequently Asked Questions

What is the IUPAC name of 4-methyl-2-(5-methyl-3H-imidazo[4,5-c]pyridin-5-ium-2-yl)quinoline?
The IUPAC name of 4-methyl-2-(5-methyl-3H-imidazo[4,5-c]pyridin-5-ium-2-yl)quinoline (CID 15644518) is 4-methyl-2-(5-methyl-3H-imidazo[4,5-c]pyridin-5-ium-2-yl)quinoline.
What is the SMILES notation for 4-methyl-2-(5-methyl-3H-imidazo[4,5-c]pyridin-5-ium-2-yl)quinoline?
The canonical SMILES for 4-methyl-2-(5-methyl-3H-imidazo[4,5-c]pyridin-5-ium-2-yl)quinoline is Cc1cc(-c2nc3cc[n+](C)cc3[nH]2)nc2ccccc12.
What is the InChIKey of 4-methyl-2-(5-methyl-3H-imidazo[4,5-c]pyridin-5-ium-2-yl)quinoline?
The InChIKey is ZCSQCUFZDMQSCX-UHFFFAOYSA-O. The full InChI is InChI=1S/C17H14N4/c1-11-9-15(18-13-6-4-3-5-12(11)13)17-19-14-7-8-21(2)10-16(14)20-17/h3-10H,1-2H3/p+1.
What are the key properties of 4-methyl-2-(5-methyl-3H-imidazo[4,5-c]pyridin-5-ium-2-yl)quinoline?
4-methyl-2-(5-methyl-3H-imidazo[4,5-c]pyridin-5-ium-2-yl)quinoline has a molecular weight of 275.33 g/mol, XLogP of 2.91, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-2-(5-methyl-3H-imidazo[4,5-c]pyridin-5-ium-2-yl)quinoline is sourced from PubChem (CID 15644518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).