1-(2-methylpropyl)-2-pentylimidazo[4,5-c]quinolin-4-amine

C19H26N4 — CID 11185992

IUPAC1-(2-methylpropyl)-2-pentylimidazo[4,5-c]quinolin-4-amine
SMILESCCCCCc1nc2c(N)nc3ccccc3c2n1CC(C)C
InChIInChI=1S/C19H26N4/c1-4-5-6-11-16-22-17-18(23(16)12-13(2)3)14-9-7-8-10-15(14)21-19(17)20/h7-10,13H,4-6,11-12H2,1-3H3,(H2,20,21)
InChIKeyXVBAMKSTUSFFIX-UHFFFAOYSA-N
MW310.44 g/mol
LogP4.56
Rot. Bonds6

About 1-(2-methylpropyl)-2-pentylimidazo[4,5-c]quinolin-4-amine

1-(2-methylpropyl)-2-pentylimidazo[4,5-c]quinolin-4-amine (PubChem CID 11185992) has the molecular formula C19H26N4 and a molecular weight of 310.44 g/mol. Its IUPAC name is 1-(2-methylpropyl)-2-pentylimidazo[4,5-c]quinolin-4-amine.

Molecular Properties

Compound Name1-(2-methylpropyl)-2-pentylimidazo[4,5-c]quinolin-4-amine
PubChem CID11185992
Molecular FormulaC19H26N4
Molecular Weight310.44 g/mol
Exact Mass310.22
IUPAC Name1-(2-methylpropyl)-2-pentylimidazo[4,5-c]quinolin-4-amine
SMILESCCCCCc1nc2c(N)nc3ccccc3c2n1CC(C)C
InChIInChI=1S/C19H26N4/c1-4-5-6-11-16-22-17-18(23(16)12-13(2)3)14-9-7-8-10-15(14)21-19(17)20/h7-10,13H,4-6,11-12H2,1-3H3,(H2,20,21)
InChIKeyXVBAMKSTUSFFIX-UHFFFAOYSA-N
XLogP4.56
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.44
LogP ≤ 54.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-heptyl-1-(2-methylpropyl)imidazo[4,5-c]quinolin-4-amine
CID 11739260
1-(2-methylpropyl)-2-propylimidazo[4,5-c]quinolin-4-amine
CID 11150246
2-butyl-1-hexylimidazo[4,5-c]quinolin-4-amine
CID 157447950
1-(4-amino-2-propylimidazo[4,5-c]quinolin-1-yl)butan-2-ol
CID 143198142
2-butyl-1-[(4-ethylphenyl)methyl]imidazo[4,5-c]quinolin-4-amine
CID 134510359
3-(4-amino-2-butylimidazo[4,5-c]quinolin-1-yl)-2,2-dimethylpropane-1-thiol
CID 166933556
2-butyl-1-(2,2-dimethylpentyl)imidazo[4,5-c]quinolin-4-amine
CID 170078321
2-[2-(2-methyl-1,3-dioxolan-2-yl)ethyl]-1-(2-methylpropyl)imidazo[4,5-c]quinolin-4-amine
CID 67052415
2-butyl-1-(furan-3-ylmethyl)imidazo[4,5-c]quinolin-4-amine
CID 177376202
1-(2-methylpropyl)-2-phenylimidazo[4,5-c]quinolin-4-amine
CID 11209291
2-butyl-1-(pyridin-3-ylmethyl)imidazo[4,5-c]quinolin-4-amine
CID 177376197
2-[(4-amino-2-butylimidazo[4,5-c]quinolin-1-yl)methyl]benzene-1,4-diol
CID 153143132

Frequently Asked Questions

What is the IUPAC name of 1-(2-methylpropyl)-2-pentylimidazo[4,5-c]quinolin-4-amine?
The IUPAC name of 1-(2-methylpropyl)-2-pentylimidazo[4,5-c]quinolin-4-amine (CID 11185992) is 1-(2-methylpropyl)-2-pentylimidazo[4,5-c]quinolin-4-amine.
What is the SMILES notation for 1-(2-methylpropyl)-2-pentylimidazo[4,5-c]quinolin-4-amine?
The canonical SMILES for 1-(2-methylpropyl)-2-pentylimidazo[4,5-c]quinolin-4-amine is CCCCCc1nc2c(N)nc3ccccc3c2n1CC(C)C.
What is the InChIKey of 1-(2-methylpropyl)-2-pentylimidazo[4,5-c]quinolin-4-amine?
The InChIKey is XVBAMKSTUSFFIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N4/c1-4-5-6-11-16-22-17-18(23(16)12-13(2)3)14-9-7-8-10-15(14)21-19(17)20/h7-10,13H,4-6,11-12H2,1-3H3,(H2,20,21).
What are the key properties of 1-(2-methylpropyl)-2-pentylimidazo[4,5-c]quinolin-4-amine?
1-(2-methylpropyl)-2-pentylimidazo[4,5-c]quinolin-4-amine has a molecular weight of 310.44 g/mol, XLogP of 4.56, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methylpropyl)-2-pentylimidazo[4,5-c]quinolin-4-amine is sourced from PubChem (CID 11185992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).