potassium 1-methyl-2-(pyridin-4-ylmethyl)indole

C15H13KN2 — CID 134893532

IUPACpotassium 1-methyl-2-(pyridin-4-ylmethyl)indole
SMILESCn1c([CH-]c2ccncc2)cc2ccccc21.[K+]
InChIInChI=1S/C15H13N2.K/c1-17-14(10-12-6-8-16-9-7-12)11-13-4-2-3-5-15(13)17;/h2-11H,1H3;/q-1;+1
InChIKeyLRYPMSVSBBXHEX-UHFFFAOYSA-N
MW260.38 g/mol
LogP0.18
Rot. Bonds2

About potassium 1-methyl-2-(pyridin-4-ylmethyl)indole

potassium 1-methyl-2-(pyridin-4-ylmethyl)indole (PubChem CID 134893532) has the molecular formula C15H13KN2 and a molecular weight of 260.38 g/mol. Its IUPAC name is potassium 1-methyl-2-(pyridin-4-ylmethyl)indole.

Molecular Properties

Compound Namepotassium 1-methyl-2-(pyridin-4-ylmethyl)indole
PubChem CID134893532
Molecular FormulaC15H13KN2
Molecular Weight260.38 g/mol
Exact Mass260.07
IUPAC Namepotassium 1-methyl-2-(pyridin-4-ylmethyl)indole
SMILESCn1c([CH-]c2ccncc2)cc2ccccc21.[K+]
InChIInChI=1S/C15H13N2.K/c1-17-14(10-12-6-8-16-9-7-12)11-13-4-2-3-5-15(13)17;/h2-11H,1H3;/q-1;+1
InChIKeyLRYPMSVSBBXHEX-UHFFFAOYSA-N
XLogP0.18
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 50.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1,2-dimethylindole;4-methylpyridine
CID 91261602
3-amino-1-methylquinolin-2-one
CID 19417653
CID 175336040
CID 175336040
5-(1-methylindol-2-yl)pyridin-3-amine
CID 58215579
1-methylpyrrolo[2,3-c]pyridin-2-amine
CID 130322156
2-[bis(phenylsulfanyl)methyl]-1-methylindole
CID 15175184
ethane;1-methylpyrrolo[3,2-c]pyridin-2-amine
CID 142426543
N,1-dimethylindol-2-amine
CID 11744928
benzene;1-methyl-2-phenylindole
CID 158316839
5-(1-methylindol-2-yl)-1H-pyrazol-4-amine
CID 115109269
methyl-(1-methylindol-2-yl)-triphenyl-λ5-phosphane
CID 173255900
2-(bromomethyl)-1-methylindole
CID 58970525

Frequently Asked Questions

What is the IUPAC name of potassium 1-methyl-2-(pyridin-4-ylmethyl)indole?
The IUPAC name of potassium 1-methyl-2-(pyridin-4-ylmethyl)indole (CID 134893532) is potassium 1-methyl-2-(pyridin-4-ylmethyl)indole.
What is the SMILES notation for potassium 1-methyl-2-(pyridin-4-ylmethyl)indole?
The canonical SMILES for potassium 1-methyl-2-(pyridin-4-ylmethyl)indole is Cn1c([CH-]c2ccncc2)cc2ccccc21.[K+].
What is the InChIKey of potassium 1-methyl-2-(pyridin-4-ylmethyl)indole?
The InChIKey is LRYPMSVSBBXHEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N2.K/c1-17-14(10-12-6-8-16-9-7-12)11-13-4-2-3-5-15(13)17;/h2-11H,1H3;/q-1;+1.
What are the key properties of potassium 1-methyl-2-(pyridin-4-ylmethyl)indole?
potassium 1-methyl-2-(pyridin-4-ylmethyl)indole has a molecular weight of 260.38 g/mol, XLogP of 0.18, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for potassium 1-methyl-2-(pyridin-4-ylmethyl)indole is sourced from PubChem (CID 134893532), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).