2-(methoxymethyl)-1-methylimidazo[4,5-c]quinolin-4-amine

C13H14N4O — CID 59795786

IUPAC2-(methoxymethyl)-1-methylimidazo[4,5-c]quinolin-4-amine
SMILESCOCc1nc2c(N)nc3ccccc3c2n1C
InChIInChI=1S/C13H14N4O/c1-17-10(7-18-2)16-11-12(17)8-5-3-4-6-9(8)15-13(11)14/h3-6H,7H2,1-2H3,(H2,14,15)
InChIKeyVTYSHZYKJOZMSH-UHFFFAOYSA-N
MW242.28 g/mol
LogP1.85
Rot. Bonds2

About 2-(methoxymethyl)-1-methylimidazo[4,5-c]quinolin-4-amine

2-(methoxymethyl)-1-methylimidazo[4,5-c]quinolin-4-amine (PubChem CID 59795786) has the molecular formula C13H14N4O and a molecular weight of 242.28 g/mol. Its IUPAC name is 2-(methoxymethyl)-1-methylimidazo[4,5-c]quinolin-4-amine.

Molecular Properties

Compound Name2-(methoxymethyl)-1-methylimidazo[4,5-c]quinolin-4-amine
PubChem CID59795786
Molecular FormulaC13H14N4O
Molecular Weight242.28 g/mol
Exact Mass242.12
IUPAC Name2-(methoxymethyl)-1-methylimidazo[4,5-c]quinolin-4-amine
SMILESCOCc1nc2c(N)nc3ccccc3c2n1C
InChIInChI=1S/C13H14N4O/c1-17-10(7-18-2)16-11-12(17)8-5-3-4-6-9(8)15-13(11)14/h3-6H,7H2,1-2H3,(H2,14,15)
InChIKeyVTYSHZYKJOZMSH-UHFFFAOYSA-N
XLogP1.85
TPSA65.96 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.28
LogP ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(ethoxymethyl)-1-methylimidazo[4,5-c]quinolin-4-amine
CID 118146427
1-methyl-2-(methylaminomethyl)imidazo[4,5-c]quinolin-4-amine
CID 59796097
1-(3-aminopropyl)-2-(ethoxymethyl)imidazo[4,5-c]quinolin-4-amine
CID 22344434
2-(ethoxymethyl)-1-ethylimidazo[4,5-c]quinolin-4-amine
CID 122646444
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-(3-aminopropyl)-2-[(propan-2-ylamino)oxymethyl]imidazo[4,5-c]quinolin-4-amine
CID 143051873
ethane;2-(ethoxymethyl)-1-methyl-8-phenylmethoxyimidazo[4,5-c]quinolin-4-amine
CID 143012779
1-(2-aminoethyl)-2-(methoxymethyl)imidazo[4,5-c][1,5]naphthyridin-4-amine
CID 68936410
2-[4-amino-2-(ethoxymethyl)imidazo[4,5-c]quinolin-1-yl]ethylcarbamic acid
CID 146308241
1-[4-amino-2-(ethoxymethyl)imidazo[4,5-c]quinolin-1-yl]-2-methylpropan-2-ol chloride
CID 76902470
O-[1-[4-amino-2-(ethoxymethyl)imidazo[4,5-c]quinolin-1-yl]-2-methylpropan-2-yl]hydroxylamine
CID 162361120

Frequently Asked Questions

What is the IUPAC name of 2-(methoxymethyl)-1-methylimidazo[4,5-c]quinolin-4-amine?
The IUPAC name of 2-(methoxymethyl)-1-methylimidazo[4,5-c]quinolin-4-amine (CID 59795786) is 2-(methoxymethyl)-1-methylimidazo[4,5-c]quinolin-4-amine.
What is the SMILES notation for 2-(methoxymethyl)-1-methylimidazo[4,5-c]quinolin-4-amine?
The canonical SMILES for 2-(methoxymethyl)-1-methylimidazo[4,5-c]quinolin-4-amine is COCc1nc2c(N)nc3ccccc3c2n1C.
What is the InChIKey of 2-(methoxymethyl)-1-methylimidazo[4,5-c]quinolin-4-amine?
The InChIKey is VTYSHZYKJOZMSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N4O/c1-17-10(7-18-2)16-11-12(17)8-5-3-4-6-9(8)15-13(11)14/h3-6H,7H2,1-2H3,(H2,14,15).
What are the key properties of 2-(methoxymethyl)-1-methylimidazo[4,5-c]quinolin-4-amine?
2-(methoxymethyl)-1-methylimidazo[4,5-c]quinolin-4-amine has a molecular weight of 242.28 g/mol, XLogP of 1.85, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methoxymethyl)-1-methylimidazo[4,5-c]quinolin-4-amine is sourced from PubChem (CID 59795786), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).