potassium 2,3-dihydroindol-1-ide

C8H8KN — CID 162731101

IUPACpotassium 2,3-dihydroindol-1-ide
SMILES[K+].c1ccc2c(c1)CC[N-]2
InChIInChI=1S/C8H8N.K/c1-2-4-8-7(3-1)5-6-9-8;/h1-4H,5-6H2;/q-1;+1
InChIKeyJJZJDLFAMVQTKT-UHFFFAOYSA-N
MW157.26 g/mol
LogP-0.75
Rot. Bonds

About potassium 2,3-dihydroindol-1-ide

potassium 2,3-dihydroindol-1-ide (PubChem CID 162731101) has the molecular formula C8H8KN and a molecular weight of 157.26 g/mol. Its IUPAC name is potassium 2,3-dihydroindol-1-ide.

Molecular Properties

Compound Namepotassium 2,3-dihydroindol-1-ide
PubChem CID162731101
Molecular FormulaC8H8KN
Molecular Weight157.26 g/mol
Exact Mass157.03
IUPAC Namepotassium 2,3-dihydroindol-1-ide
SMILES[K+].c1ccc2c(c1)CC[N-]2
InChIInChI=1S/C8H8N.K/c1-2-4-8-7(3-1)5-6-9-8;/h1-4H,5-6H2;/q-1;+1
InChIKeyJJZJDLFAMVQTKT-UHFFFAOYSA-N
XLogP-0.75
TPSA14.10 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.26
LogP ≤ 5-0.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

magnesium;3,4-dihydro-2H-quinolin-1-ide;bromide
CID 154510881
3,4-dihydro-2H-quinolin-1-ide;ethane;rubidium(1+)
CID 145270210
1,2,3,4-tetrahydronaphthalene
CID 174531863
2,3-dihydro-1H-indene;methane
CID 158581717
2,3-dihydro-1H-indene;tetrahydrochloride
CID 175293615
azane;1,2,3,4-tetrahydronaphthalene
CID 22598116
3-tert-butyl-4,5-dihydro-3H-1-benzazepin-1-id-2-one;rubidium(1+)
CID 58765126
carbanide;7-(2,3,4,5-tetramethylcyclopentyl)-2,3-dihydroindol-1-ide;titanium(4+)
CID 58351221
9,10-dihydrophenanthrene;methane
CID 174728506
tetracyclo[14.4.0.02,7.08,13]icosa-1(20),2,4,6,8,10,12,16,18-nonaene
CID 12568460
bicyclo[8.1.0]undeca-1,3,5,7,9-pentaene
CID 91124939
bicyclo[4.1.0]hepta-1,3,5-triene;methane
CID 157397080

Frequently Asked Questions

What is the IUPAC name of potassium 2,3-dihydroindol-1-ide?
The IUPAC name of potassium 2,3-dihydroindol-1-ide (CID 162731101) is potassium 2,3-dihydroindol-1-ide.
What is the SMILES notation for potassium 2,3-dihydroindol-1-ide?
The canonical SMILES for potassium 2,3-dihydroindol-1-ide is [K+].c1ccc2c(c1)CC[N-]2.
What is the InChIKey of potassium 2,3-dihydroindol-1-ide?
The InChIKey is JJZJDLFAMVQTKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8N.K/c1-2-4-8-7(3-1)5-6-9-8;/h1-4H,5-6H2;/q-1;+1.
What are the key properties of potassium 2,3-dihydroindol-1-ide?
potassium 2,3-dihydroindol-1-ide has a molecular weight of 157.26 g/mol, XLogP of -0.75, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for potassium 2,3-dihydroindol-1-ide is sourced from PubChem (CID 162731101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).