2-[4-amino-1-(3-methylbutan-2-yl)imidazo[4,5-c]quinolin-2-yl]ethanol

C17H22N4O — CID 10379948

IUPAC2-[4-amino-1-(3-methylbutan-2-yl)imidazo[4,5-c]quinolin-2-yl]ethanol
SMILESCC(C)C(C)n1c(CCO)nc2c(N)nc3ccccc3c21
InChIInChI=1S/C17H22N4O/c1-10(2)11(3)21-14(8-9-22)20-15-16(21)12-6-4-5-7-13(12)19-17(15)18/h4-7,10-11,22H,8-9H2,1-3H3,(H2,18,19)
InChIKeyOORBTIICIBHKQW-UHFFFAOYSA-N
MW298.39 g/mol
LogP2.92
Rot. Bonds4

About 2-[4-amino-1-(3-methylbutan-2-yl)imidazo[4,5-c]quinolin-2-yl]ethanol

2-[4-amino-1-(3-methylbutan-2-yl)imidazo[4,5-c]quinolin-2-yl]ethanol (PubChem CID 10379948) has the molecular formula C17H22N4O and a molecular weight of 298.39 g/mol. Its IUPAC name is 2-[4-amino-1-(3-methylbutan-2-yl)imidazo[4,5-c]quinolin-2-yl]ethanol.

Molecular Properties

Compound Name2-[4-amino-1-(3-methylbutan-2-yl)imidazo[4,5-c]quinolin-2-yl]ethanol
PubChem CID10379948
Molecular FormulaC17H22N4O
Molecular Weight298.39 g/mol
Exact Mass298.18
IUPAC Name2-[4-amino-1-(3-methylbutan-2-yl)imidazo[4,5-c]quinolin-2-yl]ethanol
SMILESCC(C)C(C)n1c(CCO)nc2c(N)nc3ccccc3c21
InChIInChI=1S/C17H22N4O/c1-10(2)11(3)21-14(8-9-22)20-15-16(21)12-6-4-5-7-13(12)19-17(15)18/h4-7,10-11,22H,8-9H2,1-3H3,(H2,18,19)
InChIKeyOORBTIICIBHKQW-UHFFFAOYSA-N
XLogP2.92
TPSA76.96 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.39
LogP ≤ 52.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-[4-amino-1-[3-(methylamino)propyl]imidazo[4,5-c]quinolin-2-yl]ethanol
CID 143284618
2-[4-amino-1-[4-(methylamino)butyl]imidazo[4,5-c]quinolin-2-yl]ethanol
CID 142032833
1-(2-methylpropyl)-2-propylimidazo[4,5-c]quinolin-4-amine
CID 11150246
1-(2-methylpropyl)-2-pentylimidazo[4,5-c]quinolin-4-amine
CID 11185992
1-[(2S)-3-methylbutan-2-yl]imidazo[4,5-c]quinolin-4-amine
CID 155368483
2-heptyl-1-(2-methylpropyl)imidazo[4,5-c]quinolin-4-amine
CID 11739260
1-(4-amino-2-propylimidazo[4,5-c]quinolin-1-yl)butan-2-ol
CID 143198142
2-[2-(2-methyl-1,3-dioxolan-2-yl)ethyl]-1-(2-methylpropyl)imidazo[4,5-c]quinolin-4-amine
CID 67052415
3-[4-amino-1-(3-hydroxypropyl)imidazo[4,5-c]quinolin-2-yl]propanamide
CID 173109370
2-ethyl-1-propylimidazo[4,5-c]quinolin-4-amine
CID 143008317
2-(methoxymethyl)-1-methylimidazo[4,5-c]quinolin-4-amine
CID 59795786
1-methyl-2-(methylaminomethyl)imidazo[4,5-c]quinolin-4-amine
CID 59796097

Frequently Asked Questions

What is the IUPAC name of 2-[4-amino-1-(3-methylbutan-2-yl)imidazo[4,5-c]quinolin-2-yl]ethanol?
The IUPAC name of 2-[4-amino-1-(3-methylbutan-2-yl)imidazo[4,5-c]quinolin-2-yl]ethanol (CID 10379948) is 2-[4-amino-1-(3-methylbutan-2-yl)imidazo[4,5-c]quinolin-2-yl]ethanol.
What is the SMILES notation for 2-[4-amino-1-(3-methylbutan-2-yl)imidazo[4,5-c]quinolin-2-yl]ethanol?
The canonical SMILES for 2-[4-amino-1-(3-methylbutan-2-yl)imidazo[4,5-c]quinolin-2-yl]ethanol is CC(C)C(C)n1c(CCO)nc2c(N)nc3ccccc3c21.
What is the InChIKey of 2-[4-amino-1-(3-methylbutan-2-yl)imidazo[4,5-c]quinolin-2-yl]ethanol?
The InChIKey is OORBTIICIBHKQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N4O/c1-10(2)11(3)21-14(8-9-22)20-15-16(21)12-6-4-5-7-13(12)19-17(15)18/h4-7,10-11,22H,8-9H2,1-3H3,(H2,18,19).
What are the key properties of 2-[4-amino-1-(3-methylbutan-2-yl)imidazo[4,5-c]quinolin-2-yl]ethanol?
2-[4-amino-1-(3-methylbutan-2-yl)imidazo[4,5-c]quinolin-2-yl]ethanol has a molecular weight of 298.39 g/mol, XLogP of 2.92, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-amino-1-(3-methylbutan-2-yl)imidazo[4,5-c]quinolin-2-yl]ethanol is sourced from PubChem (CID 10379948), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).