2-(4-aminoimidazo[4,5-c]quinolin-1-yl)-2-ethylhexan-1-ol

C18H24N4O — CID 150852921

IUPAC2-(4-aminoimidazo[4,5-c]quinolin-1-yl)-2-ethylhexan-1-ol
SMILESCCCCC(CC)(CO)n1cnc2c(N)nc3ccccc3c21
InChIInChI=1S/C18H24N4O/c1-3-5-10-18(4-2,11-23)22-12-20-15-16(22)13-8-6-7-9-14(13)21-17(15)19/h6-9,12,23H,3-5,10-11H2,1-2H3,(H2,19,21)
InChIKeyKQKAOFMHZZZKQW-UHFFFAOYSA-N
MW312.42 g/mol
LogP3.45
Rot. Bonds6

About 2-(4-aminoimidazo[4,5-c]quinolin-1-yl)-2-ethylhexan-1-ol

2-(4-aminoimidazo[4,5-c]quinolin-1-yl)-2-ethylhexan-1-ol (PubChem CID 150852921) has the molecular formula C18H24N4O and a molecular weight of 312.42 g/mol. Its IUPAC name is 2-(4-aminoimidazo[4,5-c]quinolin-1-yl)-2-ethylhexan-1-ol.

Molecular Properties

Compound Name2-(4-aminoimidazo[4,5-c]quinolin-1-yl)-2-ethylhexan-1-ol
PubChem CID150852921
Molecular FormulaC18H24N4O
Molecular Weight312.42 g/mol
Exact Mass312.20
IUPAC Name2-(4-aminoimidazo[4,5-c]quinolin-1-yl)-2-ethylhexan-1-ol
SMILESCCCCC(CC)(CO)n1cnc2c(N)nc3ccccc3c21
InChIInChI=1S/C18H24N4O/c1-3-5-10-18(4-2,11-23)22-12-20-15-16(22)13-8-6-7-9-14(13)21-17(15)19/h6-9,12,23H,3-5,10-11H2,1-2H3,(H2,19,21)
InChIKeyKQKAOFMHZZZKQW-UHFFFAOYSA-N
XLogP3.45
TPSA76.96 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.42
LogP ≤ 53.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-(4-aminoimidazo[4,5-c]quinolin-1-yl)-2-methylpropan-1-ol
CID 14986953
1-hexadecylimidazo[4,5-c]quinolin-4-amine
CID 11418374
(3S)-3-(4-aminoimidazo[4,5-c]quinolin-1-yl)-2-methylheptan-2-ol
CID 155368524
1-(3-aminopropyl)imidazo[4,5-c]quinolin-4-amine
CID 18783973
1-[(2S)-3-methylbutan-2-yl]imidazo[4,5-c]quinolin-4-amine
CID 155368483
(3R,4S)-3-(4-aminoimidazo[4,5-c]quinolin-1-yl)-4-ethoxy-2-methylpentan-2-ol
CID 146596748
1-[(1S)-1-(4-aminoimidazo[4,5-c]quinolin-1-yl)propyl]cyclopentan-1-ol
CID 150907191
2-butyl-1-(2,2-dimethylpentyl)imidazo[4,5-c]quinolin-4-amine
CID 170078321
potassium;2-methylpropan-2-olate;1-(2-methylpropyl)imidazo[4,5-c]quinolin-4-amine
CID 158181700
1-[(2R)-1-(4-butoxyphenyl)hexan-2-yl]imidazo[4,5-c]quinolin-4-amine;hydrochloride
CID 162715622
1-butyl-2-(ethylaminomethyl)imidazo[4,5-c]quinolin-4-amine
CID 175027745
1-(3-aminoprop-2-enyl)imidazo[4,5-c]quinolin-4-amine
CID 69327873

Frequently Asked Questions

What is the IUPAC name of 2-(4-aminoimidazo[4,5-c]quinolin-1-yl)-2-ethylhexan-1-ol?
The IUPAC name of 2-(4-aminoimidazo[4,5-c]quinolin-1-yl)-2-ethylhexan-1-ol (CID 150852921) is 2-(4-aminoimidazo[4,5-c]quinolin-1-yl)-2-ethylhexan-1-ol.
What is the SMILES notation for 2-(4-aminoimidazo[4,5-c]quinolin-1-yl)-2-ethylhexan-1-ol?
The canonical SMILES for 2-(4-aminoimidazo[4,5-c]quinolin-1-yl)-2-ethylhexan-1-ol is CCCCC(CC)(CO)n1cnc2c(N)nc3ccccc3c21.
What is the InChIKey of 2-(4-aminoimidazo[4,5-c]quinolin-1-yl)-2-ethylhexan-1-ol?
The InChIKey is KQKAOFMHZZZKQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N4O/c1-3-5-10-18(4-2,11-23)22-12-20-15-16(22)13-8-6-7-9-14(13)21-17(15)19/h6-9,12,23H,3-5,10-11H2,1-2H3,(H2,19,21).
What are the key properties of 2-(4-aminoimidazo[4,5-c]quinolin-1-yl)-2-ethylhexan-1-ol?
2-(4-aminoimidazo[4,5-c]quinolin-1-yl)-2-ethylhexan-1-ol has a molecular weight of 312.42 g/mol, XLogP of 3.45, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-aminoimidazo[4,5-c]quinolin-1-yl)-2-ethylhexan-1-ol is sourced from PubChem (CID 150852921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).