5-(3,5-dimethyl-1,2-oxazol-4-yl)-2'-methylspiro[1,3-dihydroindene-2,4'-5H-1,3-oxazole];6-(4,6-dimethylpyrimidin-5-yl)-2'-methylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3R)-8-(furan-3-yl)-2'-methylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];8-methoxy-2'-methyl-5-pyrimidin-5-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3R)-2'-methyl-8-(2-methylpyrazol-3-yl)spiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];2'-methyl-6-pyridazin-3-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3R)-2'-methyl-8-pyridin-3-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole]

C123H129N17O10 — CID 159521344

About 5-(3,5-dimethyl-1,2-oxazol-4-yl)-2'-methylspiro[1,3-dihydroindene-2,4'-5H-1,3-oxazole];6-(4,6-dimethylpyrimidin-5-yl)-2'-methylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3R)-8-(furan-3-yl)-2'-methylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];8-methoxy-2'-methyl-5-pyrimidin-5-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3R)-2'-methyl-8-(2-methylpyrazol-3-yl)spiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];2'-methyl-6-pyridazin-3-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3R)-2'-methyl-8-pyridin-3-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole]

5-(3,5-dimethyl-1,2-oxazol-4-yl)-2'-methylspiro[1,3-dihydroindene-2,4'-5H-1,3-oxazole];6-(4,6-dimethylpyrimidin-5-yl)-2'-methylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3R)-8-(furan-3-yl)-2'-methylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];8-methoxy-2'-methyl-5-pyrimidin-5-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3R)-2'-methyl-8-(2-methylpyrazol-3-yl)spiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];2'-methyl-6-pyridazin-3-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3R)-2'-methyl-8-pyridin-3-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole] (PubChem CID 159521344) has the molecular formula C123H129N17O10 and a molecular weight of 2005.49 g/mol. Its IUPAC name is 5-(3,5-dimethyl-1,2-oxazol-4-yl)-2'-methylspiro[1,3-dihydroindene-2,4'-5H-1,3-oxazole];6-(4,6-dimethylpyrimidin-5-yl)-2'-methylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3R)-8-(furan-3-yl)-2'-methylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];8-methoxy-2'-methyl-5-pyrimidin-5-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3R)-2'-methyl-8-(2-methylpyrazol-3-yl)spiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];2'-methyl-6-pyridazin-3-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3R)-2'-methyl-8-pyridin-3-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole].

Molecular Properties

• Compound Name: 5-(3,5-dimethyl-1,2-oxazol-4-yl)-2'-methylspiro[1,3-dihydroindene-2,4'-5H-1,3-oxazole];6-(4,6-dimethylpyrimidin-5-yl)-2'-methylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3R)-8-(furan-3-yl)-2'-methylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];8-methoxy-2'-methyl-5-pyrimidin-5-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3R)-2'-methyl-8-(2-methylpyrazol-3-yl)spiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];2'-methyl-6-pyridazin-3-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3R)-2'-methyl-8-pyridin-3-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole]
• PubChem CID: 159521344
• Molecular Formula: C123H129N17O10
• Molecular Weight: 2005.49 g/mol
• Exact Mass: 2004.01
• IUPAC Name: 5-(3,5-dimethyl-1,2-oxazol-4-yl)-2'-methylspiro[1,3-dihydroindene-2,4'-5H-1,3-oxazole];6-(4,6-dimethylpyrimidin-5-yl)-2'-methylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3R)-8-(furan-3-yl)-2'-methylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];8-methoxy-2'-methyl-5-pyrimidin-5-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3R)-2'-methyl-8-(2-methylpyrazol-3-yl)spiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];2'-methyl-6-pyridazin-3-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3R)-2'-methyl-8-pyridin-3-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole]
• SMILES: CC1=NC2(CCc3ccc(-c4c(C)ncnc4C)cc3C2)CO1.CC1=NC2(CCc3ccc(-c4cccnn4)cc3C2)CO1.CC1=NC2(CO1)Cc1ccc(-c3c(C)noc3C)cc1C2.CC1=N[C@@]2(CCc3c(cccc3-c3cccnc3)C2)CO1.CC1=N[C@@]2(CCc3c(cccc3-c3ccnn3C)C2)CO1.CC1=N[C@@]2(CCc3c(cccc3-c3ccoc3)C2)CO1.COc1ccc(-c2cncnc2)c2c1CCC1(COC(C)=N1)C2
• InChI: InChI=1S/C19H21N3O.C18H19N3O2.C18H18N2O.C17H19N3O.C17H17N3O.C17H18N2O2.C17H17NO2/c1-12-18(13(2)21-11-20-12)16-5-4-15-6-7-19(9-17(15)8-16)10-23-14(3)22-19;1-12-21-18(10-23-12)6-5-15-16(7-18)14(3-4-17(15)22-2)13-8-19-11-20-9-13;1-13-20-18(12-21-13)8-7-17-14(10-18)4-2-6-16(17)15-5-3-9-19-11-15;1-12-19-17(11-21-12)8-6-14-13(10-17)4-3-5-15(14)16-7-9-18-20(16)2;1-12-19-17(11-21-12)7-6-13-4-5-14(9-15(13)10-17)16-3-2-8-18-20-16;1-10-16(11(2)21-19-10)13-4-5-14-7-17(8-15(14)6-13)9-20-12(3)18-17;1-12-18-17(11-20-12)7-5-16-13(9-17)3-2-4-15(16)14-6-8-19-10-14/h4-5,8,11H,6-7,9-10H2,1-3H3;3-4,8-9,11H,5-7,10H2,1-2H3;2-6,9,11H,7-8,10,12H2,1H3;3-5,7,9H,6,8,10-11H2,1-2H3;2-5,8-9H,6-7,10-11H2,1H3;4-6H,7-9H2,1-3H3;2-4,6,8,10H,5,7,9,11H2,1H3/t;;18-;17-;;;17-/m..11..1/s1
• InChIKey: MBVMNWDFLNZXHA-INRZCGLISA-N
• XLogP: 22.14
• TPSA: 307.58 Ų
• H-Bond Acceptors: 27
• Rotatable Bonds: 8
• Heavy Atoms: 150
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2005.49
LogP ≤ 5	22.14
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	27

Frequently Asked Questions

What is the IUPAC name of 5-(3,5-dimethyl-1,2-oxazol-4-yl)-2'-methylspiro[1,3-dihydroindene-2,4'-5H-1,3-oxazole];6-(4,6-dimethylpyrimidin-5-yl)-2'-methylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3R)-8-(furan-3-yl)-2'-methylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];8-methoxy-2'-methyl-5-pyrimidin-5-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3R)-2'-methyl-8-(2-methylpyrazol-3-yl)spiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];2'-methyl-6-pyridazin-3-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3R)-2'-methyl-8-pyridin-3-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole]?

The IUPAC name of 5-(3,5-dimethyl-1,2-oxazol-4-yl)-2'-methylspiro[1,3-dihydroindene-2,4'-5H-1,3-oxazole];6-(4,6-dimethylpyrimidin-5-yl)-2'-methylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3R)-8-(furan-3-yl)-2'-methylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];8-methoxy-2'-methyl-5-pyrimidin-5-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3R)-2'-methyl-8-(2-methylpyrazol-3-yl)spiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];2'-methyl-6-pyridazin-3-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3R)-2'-methyl-8-pyridin-3-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole] (CID 159521344) is 5-(3,5-dimethyl-1,2-oxazol-4-yl)-2'-methylspiro[1,3-dihydroindene-2,4'-5H-1,3-oxazole];6-(4,6-dimethylpyrimidin-5-yl)-2'-methylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3R)-8-(furan-3-yl)-2'-methylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];8-methoxy-2'-methyl-5-pyrimidin-5-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3R)-2'-methyl-8-(2-methylpyrazol-3-yl)spiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];2'-methyl-6-pyridazin-3-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3R)-2'-methyl-8-pyridin-3-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole].

What is the SMILES notation for 5-(3,5-dimethyl-1,2-oxazol-4-yl)-2'-methylspiro[1,3-dihydroindene-2,4'-5H-1,3-oxazole];6-(4,6-dimethylpyrimidin-5-yl)-2'-methylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3R)-8-(furan-3-yl)-2'-methylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];8-methoxy-2'-methyl-5-pyrimidin-5-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3R)-2'-methyl-8-(2-methylpyrazol-3-yl)spiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];2'-methyl-6-pyridazin-3-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3R)-2'-methyl-8-pyridin-3-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole]?

The canonical SMILES for 5-(3,5-dimethyl-1,2-oxazol-4-yl)-2'-methylspiro[1,3-dihydroindene-2,4'-5H-1,3-oxazole];6-(4,6-dimethylpyrimidin-5-yl)-2'-methylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3R)-8-(furan-3-yl)-2'-methylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];8-methoxy-2'-methyl-5-pyrimidin-5-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3R)-2'-methyl-8-(2-methylpyrazol-3-yl)spiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];2'-methyl-6-pyridazin-3-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3R)-2'-methyl-8-pyridin-3-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole] is CC1=NC2(CCc3ccc(-c4c(C)ncnc4C)cc3C2)CO1.CC1=NC2(CCc3ccc(-c4cccnn4)cc3C2)CO1.CC1=NC2(CO1)Cc1ccc(-c3c(C)noc3C)cc1C2.CC1=N[C@@]2(CCc3c(cccc3-c3cccnc3)C2)CO1.CC1=N[C@@]2(CCc3c(cccc3-c3ccnn3C)C2)CO1.CC1=N[C@@]2(CCc3c(cccc3-c3ccoc3)C2)CO1.COc1ccc(-c2cncnc2)c2c1CCC1(COC(C)=N1)C2.

What is the InChIKey of 5-(3,5-dimethyl-1,2-oxazol-4-yl)-2'-methylspiro[1,3-dihydroindene-2,4'-5H-1,3-oxazole];6-(4,6-dimethylpyrimidin-5-yl)-2'-methylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3R)-8-(furan-3-yl)-2'-methylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];8-methoxy-2'-methyl-5-pyrimidin-5-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3R)-2'-methyl-8-(2-methylpyrazol-3-yl)spiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];2'-methyl-6-pyridazin-3-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3R)-2'-methyl-8-pyridin-3-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole]?

The InChIKey is MBVMNWDFLNZXHA-INRZCGLISA-N. The full InChI is InChI=1S/C19H21N3O.C18H19N3O2.C18H18N2O.C17H19N3O.C17H17N3O.C17H18N2O2.C17H17NO2/c1-12-18(13(2)21-11-20-12)16-5-4-15-6-7-19(9-17(15)8-16)10-23-14(3)22-19;1-12-21-18(10-23-12)6-5-15-16(7-18)14(3-4-17(15)22-2)13-8-19-11-20-9-13;1-13-20-18(12-21-13)8-7-17-14(10-18)4-2-6-16(17)15-5-3-9-19-11-15;1-12-19-17(11-21-12)8-6-14-13(10-17)4-3-5-15(14)16-7-9-18-20(16)2;1-12-19-17(11-21-12)7-6-13-4-5-14(9-15(13)10-17)16-3-2-8-18-20-16;1-10-16(11(2)21-19-10)13-4-5-14-7-17(8-15(14)6-13)9-20-12(3)18-17;1-12-18-17(11-20-12)7-5-16-13(9-17)3-2-4-15(16)14-6-8-19-10-14/h4-5,8,11H,6-7,9-10H2,1-3H3;3-4,8-9,11H,5-7,10H2,1-2H3;2-6,9,11H,7-8,10,12H2,1H3;3-5,7,9H,6,8,10-11H2,1-2H3;2-5,8-9H,6-7,10-11H2,1H3;4-6H,7-9H2,1-3H3;2-4,6,8,10H,5,7,9,11H2,1H3/t;;18-;17-;;;17-/m..11..1/s1.

What are the key properties of 5-(3,5-dimethyl-1,2-oxazol-4-yl)-2'-methylspiro[1,3-dihydroindene-2,4'-5H-1,3-oxazole];6-(4,6-dimethylpyrimidin-5-yl)-2'-methylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3R)-8-(furan-3-yl)-2'-methylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];8-methoxy-2'-methyl-5-pyrimidin-5-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3R)-2'-methyl-8-(2-methylpyrazol-3-yl)spiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];2'-methyl-6-pyridazin-3-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3R)-2'-methyl-8-pyridin-3-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole]?

5-(3,5-dimethyl-1,2-oxazol-4-yl)-2'-methylspiro[1,3-dihydroindene-2,4'-5H-1,3-oxazole];6-(4,6-dimethylpyrimidin-5-yl)-2'-methylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3R)-8-(furan-3-yl)-2'-methylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];8-methoxy-2'-methyl-5-pyrimidin-5-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3R)-2'-methyl-8-(2-methylpyrazol-3-yl)spiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];2'-methyl-6-pyridazin-3-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3R)-2'-methyl-8-pyridin-3-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole] has a molecular weight of 2005.49 g/mol, XLogP of 22.14, 8 rotatable bonds, 0 hydrogen bond donors, and 27 hydrogen bond acceptors.

Where does this data come from?

All data for 5-(3,5-dimethyl-1,2-oxazol-4-yl)-2'-methylspiro[1,3-dihydroindene-2,4'-5H-1,3-oxazole];6-(4,6-dimethylpyrimidin-5-yl)-2'-methylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3R)-8-(furan-3-yl)-2'-methylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];8-methoxy-2'-methyl-5-pyrimidin-5-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3R)-2'-methyl-8-(2-methylpyrazol-3-yl)spiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];2'-methyl-6-pyridazin-3-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3R)-2'-methyl-8-pyridin-3-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole] is sourced from PubChem (CID 159521344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).