3,5-dimethyl-4-(2-methylidene-8-propan-2-yloxy-3,5-dihydroimidazo[4,5-c]quinolin-7-yl)-1,2-oxazole;3,5-dimethyl-4-[8-methyl-2-methylidene-1-[(1R)-1-pyridin-2-ylethyl]-3H-imidazo[4,5-c]quinolin-7-yl]-1,2-oxazole;3,5-dimethyl-4-[2-(oxan-4-yl)-8-propan-2-yloxy-3H-imidazo[4,5-c]quinolin-7-yl]-1,2-oxazole;7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methyl-3-propan-2-yl-1-[(1R)-1-pyridin-2-ylethyl]imidazo[4,5-c]quinolin-2-one;7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-propan-2-yloxy-3-propyl-1H-imidazo[4,5-c]quinolin-2-one;2-methylpropane

C117H130N22O11 — CID 160657551

IUPAC3,5-dimethyl-4-(2-methylidene-8-propan-2-yloxy-3,5-dihydroimidazo[4,5-c]quinolin-7-yl)-1,2-oxazole;3,5-dimethyl-4-[8-methyl-2-methylidene-1-[(1R)-1-pyridin-2-ylethyl]-3H-imidazo[4,5-c]quinolin-7-yl]-1,2-oxazole;3,5-dimethyl-4-[2-(oxan-4-yl)-8-propan-2-yloxy-3H-imidazo[4,5-c]quinolin-7-yl]-1,2-oxazole;7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methyl-3-propan-2-yl-1-[(1R)-1-pyridin-2-ylethyl]imidazo[4,5-c]quinolin-2-one;7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-propan-2-yloxy-3-propyl-1H-imidazo[4,5-c]quinolin-2-one;2-methylpropane
SMILESC=C1Nc2cnc3cc(-c4c(C)noc4C)c(C)cc3c2N1[C@H](C)c1ccccn1.C=c1nc2c([nH]1)=CNc1cc(-c3c(C)noc3C)c(OC(C)C)cc1-2.CC(C)C.CCCn1c(=O)[nH]c2c3cc(OC(C)C)c(-c4c(C)noc4C)cc3ncc21.Cc1cc2c(cc1-c1c(C)noc1C)ncc1c2n([C@H](C)c2ccccn2)c(=O)n1C(C)C.Cc1noc(C)c1-c1cc2ncc3[nH]c(C4CCOCC4)nc3c2cc1OC(C)C
InChIInChI=1S/C26H27N5O2.C24H23N5O.C23H26N4O3.C21H24N4O3.C19H20N4O2.C4H10/c1-14(2)30-23-13-28-22-12-19(24-16(4)29-33-18(24)6)15(3)11-20(22)25(23)31(26(30)32)17(5)21-9-7-8-10-27-21;1-13-10-19-21(11-18(13)23-14(2)28-30-16(23)4)26-12-22-24(19)29(17(5)27-22)15(3)20-8-6-7-9-25-20;1-12(2)29-20-10-16-18(9-17(20)21-13(3)27-30-14(21)4)24-11-19-22(16)26-23(25-19)15-5-7-28-8-6-15;1-6-7-25-17-10-22-16-8-15(19-12(4)24-28-13(19)5)18(27-11(2)3)9-14(16)20(17)23-21(25)26;1-9(2)24-17-7-13-15(20-8-16-19(13)22-12(5)21-16)6-14(17)18-10(3)23-25-11(18)4;1-4(2)3/h7-14,17H,1-6H3;6-12,15,27H,5H2,1-4H3;9-12,15H,5-8H2,1-4H3,(H,25,26);8-11H,6-7H2,1-5H3,(H,23,26);6-9,20-21H,5H2,1-4H3;4H,1-3H3/t17-;15-;;;;/m11..../s1
InChIKeyOFNHGFKGFZVOHT-TVQLPHFBSA-N
MW2020.47 g/mol
LogP24.97
Rot. Bonds19

About 3,5-dimethyl-4-(2-methylidene-8-propan-2-yloxy-3,5-dihydroimidazo[4,5-c]quinolin-7-yl)-1,2-oxazole;3,5-dimethyl-4-[8-methyl-2-methylidene-1-[(1R)-1-pyridin-2-ylethyl]-3H-imidazo[4,5-c]quinolin-7-yl]-1,2-oxazole;3,5-dimethyl-4-[2-(oxan-4-yl)-8-propan-2-yloxy-3H-imidazo[4,5-c]quinolin-7-yl]-1,2-oxazole;7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methyl-3-propan-2-yl-1-[(1R)-1-pyridin-2-ylethyl]imidazo[4,5-c]quinolin-2-one;7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-propan-2-yloxy-3-propyl-1H-imidazo[4,5-c]quinolin-2-one;2-methylpropane

3,5-dimethyl-4-(2-methylidene-8-propan-2-yloxy-3,5-dihydroimidazo[4,5-c]quinolin-7-yl)-1,2-oxazole;3,5-dimethyl-4-[8-methyl-2-methylidene-1-[(1R)-1-pyridin-2-ylethyl]-3H-imidazo[4,5-c]quinolin-7-yl]-1,2-oxazole;3,5-dimethyl-4-[2-(oxan-4-yl)-8-propan-2-yloxy-3H-imidazo[4,5-c]quinolin-7-yl]-1,2-oxazole;7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methyl-3-propan-2-yl-1-[(1R)-1-pyridin-2-ylethyl]imidazo[4,5-c]quinolin-2-one;7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-propan-2-yloxy-3-propyl-1H-imidazo[4,5-c]quinolin-2-one;2-methylpropane (PubChem CID 160657551) has the molecular formula C117H130N22O11 and a molecular weight of 2020.47 g/mol. Its IUPAC name is 3,5-dimethyl-4-(2-methylidene-8-propan-2-yloxy-3,5-dihydroimidazo[4,5-c]quinolin-7-yl)-1,2-oxazole;3,5-dimethyl-4-[8-methyl-2-methylidene-1-[(1R)-1-pyridin-2-ylethyl]-3H-imidazo[4,5-c]quinolin-7-yl]-1,2-oxazole;3,5-dimethyl-4-[2-(oxan-4-yl)-8-propan-2-yloxy-3H-imidazo[4,5-c]quinolin-7-yl]-1,2-oxazole;7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methyl-3-propan-2-yl-1-[(1R)-1-pyridin-2-ylethyl]imidazo[4,5-c]quinolin-2-one;7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-propan-2-yloxy-3-propyl-1H-imidazo[4,5-c]quinolin-2-one;2-methylpropane.

Molecular Properties

Compound Name3,5-dimethyl-4-(2-methylidene-8-propan-2-yloxy-3,5-dihydroimidazo[4,5-c]quinolin-7-yl)-1,2-oxazole;3,5-dimethyl-4-[8-methyl-2-methylidene-1-[(1R)-1-pyridin-2-ylethyl]-3H-imidazo[4,5-c]quinolin-7-yl]-1,2-oxazole;3,5-dimethyl-4-[2-(oxan-4-yl)-8-propan-2-yloxy-3H-imidazo[4,5-c]quinolin-7-yl]-1,2-oxazole;7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methyl-3-propan-2-yl-1-[(1R)-1-pyridin-2-ylethyl]imidazo[4,5-c]quinolin-2-one;7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-propan-2-yloxy-3-propyl-1H-imidazo[4,5-c]quinolin-2-one;2-methylpropane
PubChem CID160657551
Molecular FormulaC117H130N22O11
Molecular Weight2020.47 g/mol
Exact Mass2019.03
IUPAC Name3,5-dimethyl-4-(2-methylidene-8-propan-2-yloxy-3,5-dihydroimidazo[4,5-c]quinolin-7-yl)-1,2-oxazole;3,5-dimethyl-4-[8-methyl-2-methylidene-1-[(1R)-1-pyridin-2-ylethyl]-3H-imidazo[4,5-c]quinolin-7-yl]-1,2-oxazole;3,5-dimethyl-4-[2-(oxan-4-yl)-8-propan-2-yloxy-3H-imidazo[4,5-c]quinolin-7-yl]-1,2-oxazole;7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methyl-3-propan-2-yl-1-[(1R)-1-pyridin-2-ylethyl]imidazo[4,5-c]quinolin-2-one;7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-propan-2-yloxy-3-propyl-1H-imidazo[4,5-c]quinolin-2-one;2-methylpropane
SMILESC=C1Nc2cnc3cc(-c4c(C)noc4C)c(C)cc3c2N1[C@H](C)c1ccccn1.C=c1nc2c([nH]1)=CNc1cc(-c3c(C)noc3C)c(OC(C)C)cc1-2.CC(C)C.CCCn1c(=O)[nH]c2c3cc(OC(C)C)c(-c4c(C)noc4C)cc3ncc21.Cc1cc2c(cc1-c1c(C)noc1C)ncc1c2n([C@H](C)c2ccccn2)c(=O)n1C(C)C.Cc1noc(C)c1-c1cc2ncc3[nH]c(C4CCOCC4)nc3c2cc1OC(C)C
InChIInChI=1S/C26H27N5O2.C24H23N5O.C23H26N4O3.C21H24N4O3.C19H20N4O2.C4H10/c1-14(2)30-23-13-28-22-12-19(24-16(4)29-33-18(24)6)15(3)11-20(22)25(23)31(26(30)32)17(5)21-9-7-8-10-27-21;1-13-10-19-21(11-18(13)23-14(2)28-30-16(23)4)26-12-22-24(19)29(17(5)27-22)15(3)20-8-6-7-9-25-20;1-12(2)29-20-10-16-18(9-17(20)21-13(3)27-30-14(21)4)24-11-19-22(16)26-23(25-19)15-5-7-28-8-6-15;1-6-7-25-17-10-22-16-8-15(19-12(4)24-28-13(19)5)18(27-11(2)3)9-14(16)20(17)23-21(25)26;1-9(2)24-17-7-13-15(20-8-16-19(13)22-12(5)21-16)6-14(17)18-10(3)23-25-11(18)4;1-4(2)3/h7-14,17H,1-6H3;6-12,15,27H,5H2,1-4H3;9-12,15H,5-8H2,1-4H3,(H,25,26);8-11H,6-7H2,1-5H3,(H,23,26);6-9,20-21H,5H2,1-4H3;4H,1-3H3/t17-;15-;;;;/m11..../s1
InChIKeyOFNHGFKGFZVOHT-TVQLPHFBSA-N
XLogP24.97
TPSA393.79 Ų
H-Bond Donors5
H-Bond Acceptors30
Rotatable Bonds19
Heavy Atoms150
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002020.47
LogP ≤ 524.97
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1030

Analyze 3,5-dimethyl-4-(2-methylidene-8-propan-2-yloxy-3,5-dihydroimidazo[4,5-c]quinolin-7-yl)-1,2-oxazole;3,5-dimethyl-4-[8-methyl-2-methylidene-1-[(1R)-1-pyridin-2-ylethyl]-3H-imidazo[4,5-c]quinolin-7-yl]-1,2-oxazole;3,5-dimethyl-4-[2-(oxan-4-yl)-8-propan-2-yloxy-3H-imidazo[4,5-c]quinolin-7-yl]-1,2-oxazole;7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methyl-3-propan-2-yl-1-[(1R)-1-pyridin-2-ylethyl]imidazo[4,5-c]quinolin-2-one;7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-propan-2-yloxy-3-propyl-1H-imidazo[4,5-c]quinolin-2-one;2-methylpropane with MolForge

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Frequently Asked Questions

What is the IUPAC name of 3,5-dimethyl-4-(2-methylidene-8-propan-2-yloxy-3,5-dihydroimidazo[4,5-c]quinolin-7-yl)-1,2-oxazole;3,5-dimethyl-4-[8-methyl-2-methylidene-1-[(1R)-1-pyridin-2-ylethyl]-3H-imidazo[4,5-c]quinolin-7-yl]-1,2-oxazole;3,5-dimethyl-4-[2-(oxan-4-yl)-8-propan-2-yloxy-3H-imidazo[4,5-c]quinolin-7-yl]-1,2-oxazole;7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methyl-3-propan-2-yl-1-[(1R)-1-pyridin-2-ylethyl]imidazo[4,5-c]quinolin-2-one;7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-propan-2-yloxy-3-propyl-1H-imidazo[4,5-c]quinolin-2-one;2-methylpropane?
The IUPAC name of 3,5-dimethyl-4-(2-methylidene-8-propan-2-yloxy-3,5-dihydroimidazo[4,5-c]quinolin-7-yl)-1,2-oxazole;3,5-dimethyl-4-[8-methyl-2-methylidene-1-[(1R)-1-pyridin-2-ylethyl]-3H-imidazo[4,5-c]quinolin-7-yl]-1,2-oxazole;3,5-dimethyl-4-[2-(oxan-4-yl)-8-propan-2-yloxy-3H-imidazo[4,5-c]quinolin-7-yl]-1,2-oxazole;7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methyl-3-propan-2-yl-1-[(1R)-1-pyridin-2-ylethyl]imidazo[4,5-c]quinolin-2-one;7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-propan-2-yloxy-3-propyl-1H-imidazo[4,5-c]quinolin-2-one;2-methylpropane (CID 160657551) is 3,5-dimethyl-4-(2-methylidene-8-propan-2-yloxy-3,5-dihydroimidazo[4,5-c]quinolin-7-yl)-1,2-oxazole;3,5-dimethyl-4-[8-methyl-2-methylidene-1-[(1R)-1-pyridin-2-ylethyl]-3H-imidazo[4,5-c]quinolin-7-yl]-1,2-oxazole;3,5-dimethyl-4-[2-(oxan-4-yl)-8-propan-2-yloxy-3H-imidazo[4,5-c]quinolin-7-yl]-1,2-oxazole;7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methyl-3-propan-2-yl-1-[(1R)-1-pyridin-2-ylethyl]imidazo[4,5-c]quinolin-2-one;7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-propan-2-yloxy-3-propyl-1H-imidazo[4,5-c]quinolin-2-one;2-methylpropane.
What is the SMILES notation for 3,5-dimethyl-4-(2-methylidene-8-propan-2-yloxy-3,5-dihydroimidazo[4,5-c]quinolin-7-yl)-1,2-oxazole;3,5-dimethyl-4-[8-methyl-2-methylidene-1-[(1R)-1-pyridin-2-ylethyl]-3H-imidazo[4,5-c]quinolin-7-yl]-1,2-oxazole;3,5-dimethyl-4-[2-(oxan-4-yl)-8-propan-2-yloxy-3H-imidazo[4,5-c]quinolin-7-yl]-1,2-oxazole;7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methyl-3-propan-2-yl-1-[(1R)-1-pyridin-2-ylethyl]imidazo[4,5-c]quinolin-2-one;7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-propan-2-yloxy-3-propyl-1H-imidazo[4,5-c]quinolin-2-one;2-methylpropane?
The canonical SMILES for 3,5-dimethyl-4-(2-methylidene-8-propan-2-yloxy-3,5-dihydroimidazo[4,5-c]quinolin-7-yl)-1,2-oxazole;3,5-dimethyl-4-[8-methyl-2-methylidene-1-[(1R)-1-pyridin-2-ylethyl]-3H-imidazo[4,5-c]quinolin-7-yl]-1,2-oxazole;3,5-dimethyl-4-[2-(oxan-4-yl)-8-propan-2-yloxy-3H-imidazo[4,5-c]quinolin-7-yl]-1,2-oxazole;7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methyl-3-propan-2-yl-1-[(1R)-1-pyridin-2-ylethyl]imidazo[4,5-c]quinolin-2-one;7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-propan-2-yloxy-3-propyl-1H-imidazo[4,5-c]quinolin-2-one;2-methylpropane is C=C1Nc2cnc3cc(-c4c(C)noc4C)c(C)cc3c2N1[C@H](C)c1ccccn1.C=c1nc2c([nH]1)=CNc1cc(-c3c(C)noc3C)c(OC(C)C)cc1-2.CC(C)C.CCCn1c(=O)[nH]c2c3cc(OC(C)C)c(-c4c(C)noc4C)cc3ncc21.Cc1cc2c(cc1-c1c(C)noc1C)ncc1c2n([C@H](C)c2ccccn2)c(=O)n1C(C)C.Cc1noc(C)c1-c1cc2ncc3[nH]c(C4CCOCC4)nc3c2cc1OC(C)C.
What is the InChIKey of 3,5-dimethyl-4-(2-methylidene-8-propan-2-yloxy-3,5-dihydroimidazo[4,5-c]quinolin-7-yl)-1,2-oxazole;3,5-dimethyl-4-[8-methyl-2-methylidene-1-[(1R)-1-pyridin-2-ylethyl]-3H-imidazo[4,5-c]quinolin-7-yl]-1,2-oxazole;3,5-dimethyl-4-[2-(oxan-4-yl)-8-propan-2-yloxy-3H-imidazo[4,5-c]quinolin-7-yl]-1,2-oxazole;7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methyl-3-propan-2-yl-1-[(1R)-1-pyridin-2-ylethyl]imidazo[4,5-c]quinolin-2-one;7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-propan-2-yloxy-3-propyl-1H-imidazo[4,5-c]quinolin-2-one;2-methylpropane?
The InChIKey is OFNHGFKGFZVOHT-TVQLPHFBSA-N. The full InChI is InChI=1S/C26H27N5O2.C24H23N5O.C23H26N4O3.C21H24N4O3.C19H20N4O2.C4H10/c1-14(2)30-23-13-28-22-12-19(24-16(4)29-33-18(24)6)15(3)11-20(22)25(23)31(26(30)32)17(5)21-9-7-8-10-27-21;1-13-10-19-21(11-18(13)23-14(2)28-30-16(23)4)26-12-22-24(19)29(17(5)27-22)15(3)20-8-6-7-9-25-20;1-12(2)29-20-10-16-18(9-17(20)21-13(3)27-30-14(21)4)24-11-19-22(16)26-23(25-19)15-5-7-28-8-6-15;1-6-7-25-17-10-22-16-8-15(19-12(4)24-28-13(19)5)18(27-11(2)3)9-14(16)20(17)23-21(25)26;1-9(2)24-17-7-13-15(20-8-16-19(13)22-12(5)21-16)6-14(17)18-10(3)23-25-11(18)4;1-4(2)3/h7-14,17H,1-6H3;6-12,15,27H,5H2,1-4H3;9-12,15H,5-8H2,1-4H3,(H,25,26);8-11H,6-7H2,1-5H3,(H,23,26);6-9,20-21H,5H2,1-4H3;4H,1-3H3/t17-;15-;;;;/m11..../s1.
What are the key properties of 3,5-dimethyl-4-(2-methylidene-8-propan-2-yloxy-3,5-dihydroimidazo[4,5-c]quinolin-7-yl)-1,2-oxazole;3,5-dimethyl-4-[8-methyl-2-methylidene-1-[(1R)-1-pyridin-2-ylethyl]-3H-imidazo[4,5-c]quinolin-7-yl]-1,2-oxazole;3,5-dimethyl-4-[2-(oxan-4-yl)-8-propan-2-yloxy-3H-imidazo[4,5-c]quinolin-7-yl]-1,2-oxazole;7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methyl-3-propan-2-yl-1-[(1R)-1-pyridin-2-ylethyl]imidazo[4,5-c]quinolin-2-one;7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-propan-2-yloxy-3-propyl-1H-imidazo[4,5-c]quinolin-2-one;2-methylpropane?
3,5-dimethyl-4-(2-methylidene-8-propan-2-yloxy-3,5-dihydroimidazo[4,5-c]quinolin-7-yl)-1,2-oxazole;3,5-dimethyl-4-[8-methyl-2-methylidene-1-[(1R)-1-pyridin-2-ylethyl]-3H-imidazo[4,5-c]quinolin-7-yl]-1,2-oxazole;3,5-dimethyl-4-[2-(oxan-4-yl)-8-propan-2-yloxy-3H-imidazo[4,5-c]quinolin-7-yl]-1,2-oxazole;7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methyl-3-propan-2-yl-1-[(1R)-1-pyridin-2-ylethyl]imidazo[4,5-c]quinolin-2-one;7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-propan-2-yloxy-3-propyl-1H-imidazo[4,5-c]quinolin-2-one;2-methylpropane has a molecular weight of 2020.47 g/mol, XLogP of 24.97, 19 rotatable bonds, 5 hydrogen bond donors, and 30 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dimethyl-4-(2-methylidene-8-propan-2-yloxy-3,5-dihydroimidazo[4,5-c]quinolin-7-yl)-1,2-oxazole;3,5-dimethyl-4-[8-methyl-2-methylidene-1-[(1R)-1-pyridin-2-ylethyl]-3H-imidazo[4,5-c]quinolin-7-yl]-1,2-oxazole;3,5-dimethyl-4-[2-(oxan-4-yl)-8-propan-2-yloxy-3H-imidazo[4,5-c]quinolin-7-yl]-1,2-oxazole;7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-methyl-3-propan-2-yl-1-[(1R)-1-pyridin-2-ylethyl]imidazo[4,5-c]quinolin-2-one;7-(3,5-dimethyl-1,2-oxazol-4-yl)-8-propan-2-yloxy-3-propyl-1H-imidazo[4,5-c]quinolin-2-one;2-methylpropane is sourced from PubChem (CID 160657551), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).