7-[(3,4-dichlorophenyl)methoxy]-1-(2-methylpropyl)-2-propylimidazo[4,5-c]quinolin-4-amine

C24H26Cl2N4O — CID 11351558

IUPAC7-[(3,4-dichlorophenyl)methoxy]-1-(2-methylpropyl)-2-propylimidazo[4,5-c]quinolin-4-amine
SMILESCCCc1nc2c(N)nc3cc(OCc4ccc(Cl)c(Cl)c4)ccc3c2n1CC(C)C
InChIInChI=1S/C24H26Cl2N4O/c1-4-5-21-29-22-23(30(21)12-14(2)3)17-8-7-16(11-20(17)28-24(22)27)31-13-15-6-9-18(25)19(26)10-15/h6-11,14H,4-5,12-13H2,1-3H3,(H2,27,28)
InChIKeyUWAGZUUCYVTELN-UHFFFAOYSA-N
MW457.41 g/mol
LogP6.66
Rot. Bonds7

About 7-[(3,4-dichlorophenyl)methoxy]-1-(2-methylpropyl)-2-propylimidazo[4,5-c]quinolin-4-amine

7-[(3,4-dichlorophenyl)methoxy]-1-(2-methylpropyl)-2-propylimidazo[4,5-c]quinolin-4-amine (PubChem CID 11351558) has the molecular formula C24H26Cl2N4O and a molecular weight of 457.41 g/mol. Its IUPAC name is 7-[(3,4-dichlorophenyl)methoxy]-1-(2-methylpropyl)-2-propylimidazo[4,5-c]quinolin-4-amine.

Molecular Properties

Compound Name7-[(3,4-dichlorophenyl)methoxy]-1-(2-methylpropyl)-2-propylimidazo[4,5-c]quinolin-4-amine
PubChem CID11351558
Molecular FormulaC24H26Cl2N4O
Molecular Weight457.41 g/mol
Exact Mass456.15
IUPAC Name7-[(3,4-dichlorophenyl)methoxy]-1-(2-methylpropyl)-2-propylimidazo[4,5-c]quinolin-4-amine
SMILESCCCc1nc2c(N)nc3cc(OCc4ccc(Cl)c(Cl)c4)ccc3c2n1CC(C)C
InChIInChI=1S/C24H26Cl2N4O/c1-4-5-21-29-22-23(30(21)12-14(2)3)17-8-7-16(11-20(17)28-24(22)27)31-13-15-6-9-18(25)19(26)10-15/h6-11,14H,4-5,12-13H2,1-3H3,(H2,27,28)
InChIKeyUWAGZUUCYVTELN-UHFFFAOYSA-N
XLogP6.66
TPSA65.96 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500457.41
LogP ≤ 56.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 7-[(3,4-dichlorophenyl)methoxy]-1-(2-methylpropyl)-2-propylimidazo[4,5-c]quinolin-4-amine with MolForge

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Related Compounds

1-(2-methylpropyl)-2-propyl-7-[[4-(trifluoromethyl)phenyl]methoxy]imidazo[4,5-c]quinolin-4-amine
CID 11340046
7-(3-aminopropoxy)-1-(2-methylpropyl)-2-propylimidazo[4,5-c]quinolin-4-amine
CID 58833712
1-(2-methylpropyl)-2-propylimidazo[4,5-c]quinolin-4-amine
CID 11150246
2-(2-methoxyethyl)-1-(2-methylpropyl)-7-(2-pyrrol-1-ylethoxy)imidazo[4,5-c]quinolin-4-amine
CID 143012822
1-(2-methylpropyl)-2-pentylimidazo[4,5-c]quinolin-4-amine
CID 11185992
2-heptyl-1-(2-methylpropyl)imidazo[4,5-c]quinolin-4-amine
CID 11739260
N-[2-[4-amino-2-methyl-1-(2-methylpropyl)imidazo[4,5-c]quinolin-7-yl]oxyethyl]methanesulfonamide
CID 58833656
1-(4-amino-2-propylimidazo[4,5-c]quinolin-1-yl)butan-2-ol
CID 143198142
O-[3-(4-amino-7-bromo-2-propylimidazo[4,5-c]quinolin-1-yl)propyl]hydroxylamine
CID 68539386
4-[4-amino-2-(2-hydroxyethyl)-7-phenylmethoxyimidazo[4,5-c]quinolin-1-yl]butylurea
CID 143012819
2-methyl-1-(2-methylpropyl)-7-[2-(1-methylsulfanylpiperidin-4-yl)ethoxy]imidazo[4,5-c]quinolin-4-amine
CID 143030116
methyl 1-(2-acetyloxypropyl)-4-amino-2-butylimidazo[4,5-c]quinoline-7-carboxylate
CID 130290425

Frequently Asked Questions

What is the IUPAC name of 7-[(3,4-dichlorophenyl)methoxy]-1-(2-methylpropyl)-2-propylimidazo[4,5-c]quinolin-4-amine?
The IUPAC name of 7-[(3,4-dichlorophenyl)methoxy]-1-(2-methylpropyl)-2-propylimidazo[4,5-c]quinolin-4-amine (CID 11351558) is 7-[(3,4-dichlorophenyl)methoxy]-1-(2-methylpropyl)-2-propylimidazo[4,5-c]quinolin-4-amine.
What is the SMILES notation for 7-[(3,4-dichlorophenyl)methoxy]-1-(2-methylpropyl)-2-propylimidazo[4,5-c]quinolin-4-amine?
The canonical SMILES for 7-[(3,4-dichlorophenyl)methoxy]-1-(2-methylpropyl)-2-propylimidazo[4,5-c]quinolin-4-amine is CCCc1nc2c(N)nc3cc(OCc4ccc(Cl)c(Cl)c4)ccc3c2n1CC(C)C.
What is the InChIKey of 7-[(3,4-dichlorophenyl)methoxy]-1-(2-methylpropyl)-2-propylimidazo[4,5-c]quinolin-4-amine?
The InChIKey is UWAGZUUCYVTELN-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26Cl2N4O/c1-4-5-21-29-22-23(30(21)12-14(2)3)17-8-7-16(11-20(17)28-24(22)27)31-13-15-6-9-18(25)19(26)10-15/h6-11,14H,4-5,12-13H2,1-3H3,(H2,27,28).
What are the key properties of 7-[(3,4-dichlorophenyl)methoxy]-1-(2-methylpropyl)-2-propylimidazo[4,5-c]quinolin-4-amine?
7-[(3,4-dichlorophenyl)methoxy]-1-(2-methylpropyl)-2-propylimidazo[4,5-c]quinolin-4-amine has a molecular weight of 457.41 g/mol, XLogP of 6.66, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[(3,4-dichlorophenyl)methoxy]-1-(2-methylpropyl)-2-propylimidazo[4,5-c]quinolin-4-amine is sourced from PubChem (CID 11351558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).