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

C19H25N5O — CID 10290980

IUPAC1-(2-methylpropyl)-2-(morpholin-4-ylmethyl)imidazo[4,5-c]quinolin-4-amine
SMILESCC(C)Cn1c(CN2CCOCC2)nc2c(N)nc3ccccc3c21
InChIInChI=1S/C19H25N5O/c1-13(2)11-24-16(12-23-7-9-25-10-8-23)22-17-18(24)14-5-3-4-6-15(14)21-19(17)20/h3-6,13H,7-12H2,1-2H3,(H2,20,21)
InChIKeyGTTJKTPDYQMDLA-UHFFFAOYSA-N
MW339.44 g/mol
LogP2.65
Rot. Bonds4

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

1-(2-methylpropyl)-2-(morpholin-4-ylmethyl)imidazo[4,5-c]quinolin-4-amine (PubChem CID 10290980) has the molecular formula C19H25N5O and a molecular weight of 339.44 g/mol. Its IUPAC name is 1-(2-methylpropyl)-2-(morpholin-4-ylmethyl)imidazo[4,5-c]quinolin-4-amine.

Molecular Properties

Compound Name1-(2-methylpropyl)-2-(morpholin-4-ylmethyl)imidazo[4,5-c]quinolin-4-amine
PubChem CID10290980
Molecular FormulaC19H25N5O
Molecular Weight339.44 g/mol
Exact Mass339.21
IUPAC Name1-(2-methylpropyl)-2-(morpholin-4-ylmethyl)imidazo[4,5-c]quinolin-4-amine
SMILESCC(C)Cn1c(CN2CCOCC2)nc2c(N)nc3ccccc3c21
InChIInChI=1S/C19H25N5O/c1-13(2)11-24-16(12-23-7-9-25-10-8-23)22-17-18(24)14-5-3-4-6-15(14)21-19(17)20/h3-6,13H,7-12H2,1-2H3,(H2,20,21)
InChIKeyGTTJKTPDYQMDLA-UHFFFAOYSA-N
XLogP2.65
TPSA69.20 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.44
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 1-(2-methylpropyl)-2-(morpholin-4-ylmethyl)imidazo[4,5-c]quinolin-4-amine?
The IUPAC name of 1-(2-methylpropyl)-2-(morpholin-4-ylmethyl)imidazo[4,5-c]quinolin-4-amine (CID 10290980) is 1-(2-methylpropyl)-2-(morpholin-4-ylmethyl)imidazo[4,5-c]quinolin-4-amine.
What is the SMILES notation for 1-(2-methylpropyl)-2-(morpholin-4-ylmethyl)imidazo[4,5-c]quinolin-4-amine?
The canonical SMILES for 1-(2-methylpropyl)-2-(morpholin-4-ylmethyl)imidazo[4,5-c]quinolin-4-amine is CC(C)Cn1c(CN2CCOCC2)nc2c(N)nc3ccccc3c21.
What is the InChIKey of 1-(2-methylpropyl)-2-(morpholin-4-ylmethyl)imidazo[4,5-c]quinolin-4-amine?
The InChIKey is GTTJKTPDYQMDLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N5O/c1-13(2)11-24-16(12-23-7-9-25-10-8-23)22-17-18(24)14-5-3-4-6-15(14)21-19(17)20/h3-6,13H,7-12H2,1-2H3,(H2,20,21).
What are the key properties of 1-(2-methylpropyl)-2-(morpholin-4-ylmethyl)imidazo[4,5-c]quinolin-4-amine?
1-(2-methylpropyl)-2-(morpholin-4-ylmethyl)imidazo[4,5-c]quinolin-4-amine has a molecular weight of 339.44 g/mol, XLogP of 2.65, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methylpropyl)-2-(morpholin-4-ylmethyl)imidazo[4,5-c]quinolin-4-amine is sourced from PubChem (CID 10290980), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).