potassium;2-methylpropan-2-olate;1-(2-methylpropyl)imidazo[4,5-c]quinolin-4-amine

C18H25KN4O — CID 158181700

IUPACpotassium;2-methylpropan-2-olate;1-(2-methylpropyl)imidazo[4,5-c]quinolin-4-amine
SMILESCC(C)(C)[O-].CC(C)Cn1cnc2c(N)nc3ccccc3c21.[K+]
InChIInChI=1S/C14H16N4.C4H9O.K/c1-9(2)7-18-8-16-12-13(18)10-5-3-4-6-11(10)17-14(12)15;1-4(2,3)5;/h3-6,8-9H,7H2,1-2H3,(H2,15,17);1-3H3;/q;-1;+1
InChIKeyFYRAYCJEXBHFFZ-UHFFFAOYSA-N
MW352.52 g/mol
LogP-0.03
Rot. Bonds2

About potassium;2-methylpropan-2-olate;1-(2-methylpropyl)imidazo[4,5-c]quinolin-4-amine

potassium;2-methylpropan-2-olate;1-(2-methylpropyl)imidazo[4,5-c]quinolin-4-amine (PubChem CID 158181700) has the molecular formula C18H25KN4O and a molecular weight of 352.52 g/mol. Its IUPAC name is potassium;2-methylpropan-2-olate;1-(2-methylpropyl)imidazo[4,5-c]quinolin-4-amine.

Molecular Properties

Compound Namepotassium;2-methylpropan-2-olate;1-(2-methylpropyl)imidazo[4,5-c]quinolin-4-amine
PubChem CID158181700
Molecular FormulaC18H25KN4O
Molecular Weight352.52 g/mol
Exact Mass352.17
IUPAC Namepotassium;2-methylpropan-2-olate;1-(2-methylpropyl)imidazo[4,5-c]quinolin-4-amine
SMILESCC(C)(C)[O-].CC(C)Cn1cnc2c(N)nc3ccccc3c21.[K+]
InChIInChI=1S/C14H16N4.C4H9O.K/c1-9(2)7-18-8-16-12-13(18)10-5-3-4-6-11(10)17-14(12)15;1-4(2,3)5;/h3-6,8-9H,7H2,1-2H3,(H2,15,17);1-3H3;/q;-1;+1
InChIKeyFYRAYCJEXBHFFZ-UHFFFAOYSA-N
XLogP-0.03
TPSA79.79 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.52
LogP ≤ 5-0.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

[1-(2-methylpropyl)imidazo[4,5-c]quinolin-4-yl]hydrazine
CID 11107934
N'-[1-(2-methylpropyl)imidazo[4,5-c]quinolin-4-yl]methanediamine
CID 71085783
6-methyl-1-(2-methylpropyl)imidazo[4,5-c]quinolin-4-amine
CID 11253823
1-(3-aminopropyl)imidazo[4,5-c]quinolin-4-amine
CID 18783973
2-[4-amino-1-(2-methylpropyl)imidazo[4,5-c]quinolin-7-yl]oxy-1-phenylethanone
CID 163786847
1-hexadecylimidazo[4,5-c]quinolin-4-amine
CID 11418374
1-[(2S)-3-methylbutan-2-yl]imidazo[4,5-c]quinolin-4-amine
CID 155368483
1-(3-aminoprop-2-enyl)imidazo[4,5-c]quinolin-4-amine
CID 69327873
2-(4-aminoimidazo[4,5-c]quinolin-1-yl)-2-methylpropan-1-ol
CID 14986953
2,2-dimethyl-N-[2-[[1-(2-methylpropyl)imidazo[4,5-c]quinolin-4-yl]amino]-2-oxoethyl]propanamide
CID 162785225
1-[2-methyl-2-(2-methylsulfonylethoxy)propyl]imidazo[4,5-c]quinolin-4-amine
CID 58917318
1-[(4E)-4-methoxyimino-2,2-dimethylpentyl]imidazo[4,5-c]quinolin-4-amine
CID 58869100

Frequently Asked Questions

What is the IUPAC name of potassium;2-methylpropan-2-olate;1-(2-methylpropyl)imidazo[4,5-c]quinolin-4-amine?
The IUPAC name of potassium;2-methylpropan-2-olate;1-(2-methylpropyl)imidazo[4,5-c]quinolin-4-amine (CID 158181700) is potassium;2-methylpropan-2-olate;1-(2-methylpropyl)imidazo[4,5-c]quinolin-4-amine.
What is the SMILES notation for potassium;2-methylpropan-2-olate;1-(2-methylpropyl)imidazo[4,5-c]quinolin-4-amine?
The canonical SMILES for potassium;2-methylpropan-2-olate;1-(2-methylpropyl)imidazo[4,5-c]quinolin-4-amine is CC(C)(C)[O-].CC(C)Cn1cnc2c(N)nc3ccccc3c21.[K+].
What is the InChIKey of potassium;2-methylpropan-2-olate;1-(2-methylpropyl)imidazo[4,5-c]quinolin-4-amine?
The InChIKey is FYRAYCJEXBHFFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N4.C4H9O.K/c1-9(2)7-18-8-16-12-13(18)10-5-3-4-6-11(10)17-14(12)15;1-4(2,3)5;/h3-6,8-9H,7H2,1-2H3,(H2,15,17);1-3H3;/q;-1;+1.
What are the key properties of potassium;2-methylpropan-2-olate;1-(2-methylpropyl)imidazo[4,5-c]quinolin-4-amine?
potassium;2-methylpropan-2-olate;1-(2-methylpropyl)imidazo[4,5-c]quinolin-4-amine has a molecular weight of 352.52 g/mol, XLogP of -0.03, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for potassium;2-methylpropan-2-olate;1-(2-methylpropyl)imidazo[4,5-c]quinolin-4-amine is sourced from PubChem (CID 158181700), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).