1-butyl-2-(ethylaminomethyl)imidazo[4,5-c]quinolin-4-amine

C17H23N5 — CID 175027745

IUPAC1-butyl-2-(ethylaminomethyl)imidazo[4,5-c]quinolin-4-amine
SMILESCCCCn1c(CNCC)nc2c(N)nc3ccccc3c21
InChIInChI=1S/C17H23N5/c1-3-5-10-22-14(11-19-4-2)21-15-16(22)12-8-6-7-9-13(12)20-17(15)18/h6-9,19H,3-5,10-11H2,1-2H3,(H2,18,20)
InChIKeyKXEOZCJBTSNTSV-UHFFFAOYSA-N
MW297.41 g/mol
LogP3.08
Rot. Bonds6

About 1-butyl-2-(ethylaminomethyl)imidazo[4,5-c]quinolin-4-amine

1-butyl-2-(ethylaminomethyl)imidazo[4,5-c]quinolin-4-amine (PubChem CID 175027745) has the molecular formula C17H23N5 and a molecular weight of 297.41 g/mol. Its IUPAC name is 1-butyl-2-(ethylaminomethyl)imidazo[4,5-c]quinolin-4-amine.

Molecular Properties

Compound Name1-butyl-2-(ethylaminomethyl)imidazo[4,5-c]quinolin-4-amine
PubChem CID175027745
Molecular FormulaC17H23N5
Molecular Weight297.41 g/mol
Exact Mass297.20
IUPAC Name1-butyl-2-(ethylaminomethyl)imidazo[4,5-c]quinolin-4-amine
SMILESCCCCn1c(CNCC)nc2c(N)nc3ccccc3c21
InChIInChI=1S/C17H23N5/c1-3-5-10-22-14(11-19-4-2)21-15-16(22)12-8-6-7-9-13(12)20-17(15)18/h6-9,19H,3-5,10-11H2,1-2H3,(H2,18,20)
InChIKeyKXEOZCJBTSNTSV-UHFFFAOYSA-N
XLogP3.08
TPSA68.76 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.41
LogP ≤ 53.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

[4-(4-amino-2-butylimidazo[4,5-c]quinolin-1-yl)butylamino]methanol
CID 138457331
2-butyl-1-hexylimidazo[4,5-c]quinolin-4-amine
CID 157447950
4-(4-amino-2-propylimidazo[4,5-c]quinolin-1-yl)butanoic acid
CID 141281240
1-(4-chlorobutyl)-2-propylimidazo[4,5-c]quinolin-4-amine
CID 22320471
2-ethyl-1-propylimidazo[4,5-c]quinolin-4-amine
CID 143008317
ethane;2-ethyl-1-propylimidazo[4,5-c]quinolin-4-amine
CID 143284639
1-(4-butylsulfanylbutyl)-2-ethylimidazo[4,5-c]quinolin-4-amine
CID 10309036
N-[3-(4-amino-2-butylimidazo[4,5-c]quinolin-1-yl)propyl]benzamide
CID 23512725
2-butyl-1-[4-(ethylaminooxy)butyl]imidazo[4,5-c]quinolin-4-amine;ethane
CID 143008375
N-[4-[4-amino-2-(ethylaminomethyl)imidazo[4,5-c]quinolin-1-yl]butyl]-N-(2-methyloxolan-3-yl)acetamide
CID 155174989
2-[4-(4-amino-2-butylimidazo[4,5-c]quinolin-1-yl)butyl]guanidine;hydrochloride
CID 126650986
4-[4-(4-amino-2-butylimidazo[4,5-c]quinolin-1-yl)butylamino]-4-oxobutanoic acid
CID 135137543

Frequently Asked Questions

What is the IUPAC name of 1-butyl-2-(ethylaminomethyl)imidazo[4,5-c]quinolin-4-amine?
The IUPAC name of 1-butyl-2-(ethylaminomethyl)imidazo[4,5-c]quinolin-4-amine (CID 175027745) is 1-butyl-2-(ethylaminomethyl)imidazo[4,5-c]quinolin-4-amine.
What is the SMILES notation for 1-butyl-2-(ethylaminomethyl)imidazo[4,5-c]quinolin-4-amine?
The canonical SMILES for 1-butyl-2-(ethylaminomethyl)imidazo[4,5-c]quinolin-4-amine is CCCCn1c(CNCC)nc2c(N)nc3ccccc3c21.
What is the InChIKey of 1-butyl-2-(ethylaminomethyl)imidazo[4,5-c]quinolin-4-amine?
The InChIKey is KXEOZCJBTSNTSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N5/c1-3-5-10-22-14(11-19-4-2)21-15-16(22)12-8-6-7-9-13(12)20-17(15)18/h6-9,19H,3-5,10-11H2,1-2H3,(H2,18,20).
What are the key properties of 1-butyl-2-(ethylaminomethyl)imidazo[4,5-c]quinolin-4-amine?
1-butyl-2-(ethylaminomethyl)imidazo[4,5-c]quinolin-4-amine has a molecular weight of 297.41 g/mol, XLogP of 3.08, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-butyl-2-(ethylaminomethyl)imidazo[4,5-c]quinolin-4-amine is sourced from PubChem (CID 175027745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).