1-(4-amino-2-butyl-7-chloroimidazo[4,5-c]quinolin-1-yl)-2-methylpropan-2-ol

C18H23ClN4O — CID 155213433

IUPAC1-(4-amino-2-butyl-7-chloroimidazo[4,5-c]quinolin-1-yl)-2-methylpropan-2-ol
SMILESCCCCc1nc2c(N)nc3cc(Cl)ccc3c2n1CC(C)(C)O
InChIInChI=1S/C18H23ClN4O/c1-4-5-6-14-22-15-16(23(14)10-18(2,3)24)12-8-7-11(19)9-13(12)21-17(15)20/h7-9,24H,4-6,10H2,1-3H3,(H2,20,21)
InChIKeyMVENUAKDNZKDGF-UHFFFAOYSA-N
MW346.86 g/mol
LogP3.93
Rot. Bonds5

About 1-(4-amino-2-butyl-7-chloroimidazo[4,5-c]quinolin-1-yl)-2-methylpropan-2-ol

1-(4-amino-2-butyl-7-chloroimidazo[4,5-c]quinolin-1-yl)-2-methylpropan-2-ol (PubChem CID 155213433) has the molecular formula C18H23ClN4O and a molecular weight of 346.86 g/mol. Its IUPAC name is 1-(4-amino-2-butyl-7-chloroimidazo[4,5-c]quinolin-1-yl)-2-methylpropan-2-ol.

Molecular Properties

Compound Name1-(4-amino-2-butyl-7-chloroimidazo[4,5-c]quinolin-1-yl)-2-methylpropan-2-ol
PubChem CID155213433
Molecular FormulaC18H23ClN4O
Molecular Weight346.86 g/mol
Exact Mass346.16
IUPAC Name1-(4-amino-2-butyl-7-chloroimidazo[4,5-c]quinolin-1-yl)-2-methylpropan-2-ol
SMILESCCCCc1nc2c(N)nc3cc(Cl)ccc3c2n1CC(C)(C)O
InChIInChI=1S/C18H23ClN4O/c1-4-5-6-14-22-15-16(23(14)10-18(2,3)24)12-8-7-11(19)9-13(12)21-17(15)20/h7-9,24H,4-6,10H2,1-3H3,(H2,20,21)
InChIKeyMVENUAKDNZKDGF-UHFFFAOYSA-N
XLogP3.93
TPSA76.96 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.86
LogP ≤ 53.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 1-(4-amino-2-butyl-7-chloroimidazo[4,5-c]quinolin-1-yl)-2-methylpropan-2-ol with MolForge

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Related Compounds

Resiquimod
CID 159603
4-Amino-2-((ethylamino)methyl)-alpha,alpha-dimethyl-1H-imidazo(4,5-c)quinoline-1-ethanol
CID 44592366
1-[[4-(Aminomethyl)phenyl]methyl]-2-Butyl-Imidazo[4,5-C]quinolin-4-Amine
CID 52945312
1-(4-Amino-2-Butyl-1h-Imidazo[4,5-C]quinolin-1-Yl)-2-Methylpropan-2-Ol
CID 21470208
1-[[3-(Aminomethyl)phenyl]methyl]-2-Butyl-Imidazo[4,5-C]quinolin-4-Amine
CID 52944297
9-Chloro-6-ethyl-6H-indolo(2,3-b)quinoxaline
CID 1523680
9-Chloro-6-methylindolo[3,2-b]quinoxaline
CID 3155707
1-[4-Amino-7-chloro-2-(ethoxymethyl)imidazo[4,5-c]quinolin-1-yl]-2-methylpropan-2-ol
CID 10089136
2-[[7-(2-Chloro-6-methylanilino)-2,4,8,13-tetrazatricyclo[7.4.0.02,6]trideca-1(9),3,5,7,10,12-hexaen-12-yl]-methylamino]ethanol
CID 11280527
2-[[7-(2-Chloro-6-methylanilino)-2,4,8,13-tetrazatricyclo[7.4.0.02,6]trideca-1(9),3,5,7,10,12-hexaen-12-yl]-(2-hydroxyethyl)amino]ethanol
CID 11361958
1-Benzyl-2-methyl-1H-imidazo[4,5-c]quinolin-4-amine
CID 13982892
1-Benzyl-2-ethyl-1H-imidazo[4,5-c]quinolin-4-amine
CID 46830487

Frequently Asked Questions

What is the IUPAC name of 1-(4-amino-2-butyl-7-chloroimidazo[4,5-c]quinolin-1-yl)-2-methylpropan-2-ol?
The IUPAC name of 1-(4-amino-2-butyl-7-chloroimidazo[4,5-c]quinolin-1-yl)-2-methylpropan-2-ol (CID 155213433) is 1-(4-amino-2-butyl-7-chloroimidazo[4,5-c]quinolin-1-yl)-2-methylpropan-2-ol.
What is the SMILES notation for 1-(4-amino-2-butyl-7-chloroimidazo[4,5-c]quinolin-1-yl)-2-methylpropan-2-ol?
The canonical SMILES for 1-(4-amino-2-butyl-7-chloroimidazo[4,5-c]quinolin-1-yl)-2-methylpropan-2-ol is CCCCc1nc2c(N)nc3cc(Cl)ccc3c2n1CC(C)(C)O.
What is the InChIKey of 1-(4-amino-2-butyl-7-chloroimidazo[4,5-c]quinolin-1-yl)-2-methylpropan-2-ol?
The InChIKey is MVENUAKDNZKDGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23ClN4O/c1-4-5-6-14-22-15-16(23(14)10-18(2,3)24)12-8-7-11(19)9-13(12)21-17(15)20/h7-9,24H,4-6,10H2,1-3H3,(H2,20,21).
What are the key properties of 1-(4-amino-2-butyl-7-chloroimidazo[4,5-c]quinolin-1-yl)-2-methylpropan-2-ol?
1-(4-amino-2-butyl-7-chloroimidazo[4,5-c]quinolin-1-yl)-2-methylpropan-2-ol has a molecular weight of 346.86 g/mol, XLogP of 3.93, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-amino-2-butyl-7-chloroimidazo[4,5-c]quinolin-1-yl)-2-methylpropan-2-ol is sourced from PubChem (CID 155213433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).