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

C18H25N4O2P — CID 59796222

IUPAC2-(dimethylphosphorylmethoxymethyl)-1-(2-methylpropyl)imidazo[4,5-c]quinolin-4-amine
SMILESCC(C)Cn1c(COCP(C)(C)=O)nc2c(N)nc3ccccc3c21
InChIInChI=1S/C18H25N4O2P/c1-12(2)9-22-15(10-24-11-25(3,4)23)21-16-17(22)13-7-5-6-8-14(13)20-18(16)19/h5-8,12H,9-11H2,1-4H3,(H2,19,20)
InChIKeyFMVZVDGFEXSWAF-UHFFFAOYSA-N
MW360.40 g/mol
LogP3.92
Rot. Bonds6

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

2-(dimethylphosphorylmethoxymethyl)-1-(2-methylpropyl)imidazo[4,5-c]quinolin-4-amine (PubChem CID 59796222) has the molecular formula C18H25N4O2P and a molecular weight of 360.40 g/mol. Its IUPAC name is 2-(dimethylphosphorylmethoxymethyl)-1-(2-methylpropyl)imidazo[4,5-c]quinolin-4-amine.

Molecular Properties

Compound Name2-(dimethylphosphorylmethoxymethyl)-1-(2-methylpropyl)imidazo[4,5-c]quinolin-4-amine
PubChem CID59796222
Molecular FormulaC18H25N4O2P
Molecular Weight360.40 g/mol
Exact Mass360.17
IUPAC Name2-(dimethylphosphorylmethoxymethyl)-1-(2-methylpropyl)imidazo[4,5-c]quinolin-4-amine
SMILESCC(C)Cn1c(COCP(C)(C)=O)nc2c(N)nc3ccccc3c21
InChIInChI=1S/C18H25N4O2P/c1-12(2)9-22-15(10-24-11-25(3,4)23)21-16-17(22)13-7-5-6-8-14(13)20-18(16)19/h5-8,12H,9-11H2,1-4H3,(H2,19,20)
InChIKeyFMVZVDGFEXSWAF-UHFFFAOYSA-N
XLogP3.92
TPSA83.03 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.40
LogP ≤ 53.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

1-(2-methylpropyl)-2-propylimidazo[4,5-c]quinolin-4-amine
CID 11150246
2-(ethoxymethyl)-1-ethylimidazo[4,5-c]quinolin-4-amine
CID 122646444
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
1-(2-methylpropyl)-2-phenylimidazo[4,5-c]quinolin-4-amine
CID 11209291
2-[2-(2-methyl-1,3-dioxolan-2-yl)ethyl]-1-(2-methylpropyl)imidazo[4,5-c]quinolin-4-amine
CID 67052415
2-N-methyl-1-(2-methylpropyl)imidazo[4,5-c]quinoline-2,4-diamine
CID 11630397
1-(2-methylpropyl)-2-(piperazin-1-ylmethyl)imidazo[4,5-c]quinolin-4-amine
CID 69318179
1-(2-methylpropyl)-2-(morpholin-4-ylmethyl)imidazo[4,5-c]quinolin-4-amine
CID 10290980
1-(3-aminopropyl)-2-(ethoxymethyl)imidazo[4,5-c]quinolin-4-amine
CID 22344434
2-(ethoxymethyl)-1-methylimidazo[4,5-c]quinolin-4-amine
CID 118146427
2-[[(E)-ethylideneamino]oxymethyl]-1-(2-methylpropyl)imidazo[4,5-c]quinolin-4-amine;3-methylpyridine
CID 143051741

Frequently Asked Questions

What is the IUPAC name of 2-(dimethylphosphorylmethoxymethyl)-1-(2-methylpropyl)imidazo[4,5-c]quinolin-4-amine?
The IUPAC name of 2-(dimethylphosphorylmethoxymethyl)-1-(2-methylpropyl)imidazo[4,5-c]quinolin-4-amine (CID 59796222) is 2-(dimethylphosphorylmethoxymethyl)-1-(2-methylpropyl)imidazo[4,5-c]quinolin-4-amine.
What is the SMILES notation for 2-(dimethylphosphorylmethoxymethyl)-1-(2-methylpropyl)imidazo[4,5-c]quinolin-4-amine?
The canonical SMILES for 2-(dimethylphosphorylmethoxymethyl)-1-(2-methylpropyl)imidazo[4,5-c]quinolin-4-amine is CC(C)Cn1c(COCP(C)(C)=O)nc2c(N)nc3ccccc3c21.
What is the InChIKey of 2-(dimethylphosphorylmethoxymethyl)-1-(2-methylpropyl)imidazo[4,5-c]quinolin-4-amine?
The InChIKey is FMVZVDGFEXSWAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25N4O2P/c1-12(2)9-22-15(10-24-11-25(3,4)23)21-16-17(22)13-7-5-6-8-14(13)20-18(16)19/h5-8,12H,9-11H2,1-4H3,(H2,19,20).
What are the key properties of 2-(dimethylphosphorylmethoxymethyl)-1-(2-methylpropyl)imidazo[4,5-c]quinolin-4-amine?
2-(dimethylphosphorylmethoxymethyl)-1-(2-methylpropyl)imidazo[4,5-c]quinolin-4-amine has a molecular weight of 360.40 g/mol, XLogP of 3.92, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dimethylphosphorylmethoxymethyl)-1-(2-methylpropyl)imidazo[4,5-c]quinolin-4-amine is sourced from PubChem (CID 59796222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).