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

C17H22N4O2 — CID 150473168

IUPAC4-(4-aminoimidazo[4,5-c]quinolin-1-yl)-5-methoxy-2-methylpentan-2-ol
SMILESCOCC(CC(C)(C)O)n1cnc2c(N)nc3ccccc3c21
InChIInChI=1S/C17H22N4O2/c1-17(2,22)8-11(9-23-3)21-10-19-14-15(21)12-6-4-5-7-13(12)20-16(14)18/h4-7,10-11,22H,8-9H2,1-3H3,(H2,18,20)
InChIKeyHSFWIRKOUMMWPC-UHFFFAOYSA-N
MW314.39 g/mol
LogP2.52
Rot. Bonds5

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

4-(4-aminoimidazo[4,5-c]quinolin-1-yl)-5-methoxy-2-methylpentan-2-ol (PubChem CID 150473168) has the molecular formula C17H22N4O2 and a molecular weight of 314.39 g/mol. Its IUPAC name is 4-(4-aminoimidazo[4,5-c]quinolin-1-yl)-5-methoxy-2-methylpentan-2-ol.

Molecular Properties

Compound Name4-(4-aminoimidazo[4,5-c]quinolin-1-yl)-5-methoxy-2-methylpentan-2-ol
PubChem CID150473168
Molecular FormulaC17H22N4O2
Molecular Weight314.39 g/mol
Exact Mass314.17
IUPAC Name4-(4-aminoimidazo[4,5-c]quinolin-1-yl)-5-methoxy-2-methylpentan-2-ol
SMILESCOCC(CC(C)(C)O)n1cnc2c(N)nc3ccccc3c21
InChIInChI=1S/C17H22N4O2/c1-17(2,22)8-11(9-23-3)21-10-19-14-15(21)12-6-4-5-7-13(12)20-16(14)18/h4-7,10-11,22H,8-9H2,1-3H3,(H2,18,20)
InChIKeyHSFWIRKOUMMWPC-UHFFFAOYSA-N
XLogP2.52
TPSA86.19 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.39
LogP ≤ 52.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 4-(4-aminoimidazo[4,5-c]quinolin-1-yl)-5-methoxy-2-methylpentan-2-ol with MolForge

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Related Compounds

1-[(2R)-1-methoxy-3-phenylpropan-2-yl]imidazo[4,5-c]quinolin-4-amine;hydrochloride
CID 162715621
(3R,4S)-3-(4-aminoimidazo[4,5-c]quinolin-1-yl)-4-ethoxy-2-methylpentan-2-ol
CID 146596748
(3S)-3-(4-aminoimidazo[4,5-c]quinolin-1-yl)-2-methylheptan-2-ol
CID 155368524
1-[(2S)-3-methylbutan-2-yl]imidazo[4,5-c]quinolin-4-amine
CID 155368483
1-[1-(2-aminoethoxy)ethyl]imidazo[4,5-c]quinolin-4-amine
CID 152657233
1-(3-methyl-3-phenylmethoxybutan-2-yl)imidazo[4,5-c]quinolin-4-amine
CID 23395856
1-[(2R)-1-ethoxy-3-methylbutan-2-yl]imidazo[4,5-c]quinolin-4-amine
CID 146637091
1-[1-(2-piperidin-4-ylethoxy)butan-2-yl]imidazo[4,5-c]quinolin-4-amine
CID 10270339
1-[1-(4-butoxyphenyl)-3-ethoxypropan-2-yl]imidazo[4,5-c]quinolin-4-amine
CID 155355545
4-[2-(4-aminoimidazo[4,5-c]quinolin-1-yl)-3-methylbutoxy]benzoic acid
CID 59119319
1-[(2R)-1-(4-butoxyphenyl)hexan-2-yl]imidazo[4,5-c]quinolin-4-amine;hydrochloride
CID 162715622
2-(4-aminoimidazo[4,5-c]quinolin-1-yl)-2-methylpropan-1-ol
CID 14986953

Frequently Asked Questions

What is the IUPAC name of 4-(4-aminoimidazo[4,5-c]quinolin-1-yl)-5-methoxy-2-methylpentan-2-ol?
The IUPAC name of 4-(4-aminoimidazo[4,5-c]quinolin-1-yl)-5-methoxy-2-methylpentan-2-ol (CID 150473168) is 4-(4-aminoimidazo[4,5-c]quinolin-1-yl)-5-methoxy-2-methylpentan-2-ol.
What is the SMILES notation for 4-(4-aminoimidazo[4,5-c]quinolin-1-yl)-5-methoxy-2-methylpentan-2-ol?
The canonical SMILES for 4-(4-aminoimidazo[4,5-c]quinolin-1-yl)-5-methoxy-2-methylpentan-2-ol is COCC(CC(C)(C)O)n1cnc2c(N)nc3ccccc3c21.
What is the InChIKey of 4-(4-aminoimidazo[4,5-c]quinolin-1-yl)-5-methoxy-2-methylpentan-2-ol?
The InChIKey is HSFWIRKOUMMWPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N4O2/c1-17(2,22)8-11(9-23-3)21-10-19-14-15(21)12-6-4-5-7-13(12)20-16(14)18/h4-7,10-11,22H,8-9H2,1-3H3,(H2,18,20).
What are the key properties of 4-(4-aminoimidazo[4,5-c]quinolin-1-yl)-5-methoxy-2-methylpentan-2-ol?
4-(4-aminoimidazo[4,5-c]quinolin-1-yl)-5-methoxy-2-methylpentan-2-ol has a molecular weight of 314.39 g/mol, XLogP of 2.52, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-aminoimidazo[4,5-c]quinolin-1-yl)-5-methoxy-2-methylpentan-2-ol is sourced from PubChem (CID 150473168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).