6-(1-bicyclo[2.2.1]heptanyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(2-bicyclo[2.2.1]heptanyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(3-bicyclo[4.1.0]heptanyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(2-bicyclo[2.2.1]heptanylmethyl)-8-methylsulfanyl-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(2-bicyclo[3.1.0]hexanylmethyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(3-bicyclo[3.2.1]octanyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(6-bicyclo[3.2.1]octanyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(3-bicyclo[3.2.1]octanylmethyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(6-bicyclo[3.2.1]octanylmethyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(cyclobutylmethyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-cyclohex-3-en-1-yl-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(cyclopropylmethyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one

C181H257N35O24S — CID 159273281

About 6-(1-bicyclo[2.2.1]heptanyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(2-bicyclo[2.2.1]heptanyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(3-bicyclo[4.1.0]heptanyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(2-bicyclo[2.2.1]heptanylmethyl)-8-methylsulfanyl-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(2-bicyclo[3.1.0]hexanylmethyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(3-bicyclo[3.2.1]octanyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(6-bicyclo[3.2.1]octanyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(3-bicyclo[3.2.1]octanylmethyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(6-bicyclo[3.2.1]octanylmethyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(cyclobutylmethyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-cyclohex-3-en-1-yl-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(cyclopropylmethyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one

6-(1-bicyclo[2.2.1]heptanyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(2-bicyclo[2.2.1]heptanyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(3-bicyclo[4.1.0]heptanyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(2-bicyclo[2.2.1]heptanylmethyl)-8-methylsulfanyl-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(2-bicyclo[3.1.0]hexanylmethyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(3-bicyclo[3.2.1]octanyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(6-bicyclo[3.2.1]octanyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(3-bicyclo[3.2.1]octanylmethyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(6-bicyclo[3.2.1]octanylmethyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(cyclobutylmethyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-cyclohex-3-en-1-yl-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(cyclopropylmethyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one (PubChem CID 159273281) has the molecular formula C181H257N35O24S and a molecular weight of 3339.33 g/mol. Its IUPAC name is 6-(1-bicyclo[2.2.1]heptanyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(2-bicyclo[2.2.1]heptanyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(3-bicyclo[4.1.0]heptanyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(2-bicyclo[2.2.1]heptanylmethyl)-8-methylsulfanyl-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(2-bicyclo[3.1.0]hexanylmethyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(3-bicyclo[3.2.1]octanyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(6-bicyclo[3.2.1]octanyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(3-bicyclo[3.2.1]octanylmethyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(6-bicyclo[3.2.1]octanylmethyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(cyclobutylmethyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-cyclohex-3-en-1-yl-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(cyclopropylmethyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one.

Molecular Properties

• Compound Name: 6-(1-bicyclo[2.2.1]heptanyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(2-bicyclo[2.2.1]heptanyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(3-bicyclo[4.1.0]heptanyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(2-bicyclo[2.2.1]heptanylmethyl)-8-methylsulfanyl-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(2-bicyclo[3.1.0]hexanylmethyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(3-bicyclo[3.2.1]octanyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(6-bicyclo[3.2.1]octanyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(3-bicyclo[3.2.1]octanylmethyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(6-bicyclo[3.2.1]octanylmethyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(cyclobutylmethyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-cyclohex-3-en-1-yl-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(cyclopropylmethyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one
• PubChem CID: 159273281
• Molecular Formula: C181H257N35O24S
• Molecular Weight: 3339.33 g/mol
• Exact Mass: 3336.97
• IUPAC Name: 6-(1-bicyclo[2.2.1]heptanyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(2-bicyclo[2.2.1]heptanyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(3-bicyclo[4.1.0]heptanyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(2-bicyclo[2.2.1]heptanylmethyl)-8-methylsulfanyl-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(2-bicyclo[3.1.0]hexanylmethyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(3-bicyclo[3.2.1]octanyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(6-bicyclo[3.2.1]octanyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(3-bicyclo[3.2.1]octanylmethyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(6-bicyclo[3.2.1]octanylmethyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(cyclobutylmethyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-cyclohex-3-en-1-yl-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(cyclopropylmethyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one
• SMILES: CNC1C(=O)N(C23CCC(CC2)C3)CCc2ncoc21.CNC1C(=O)N(C2CC3CCC(C3)C2)CCc2ncoc21.CNC1C(=O)N(C2CC3CCC2C3)CCc2ncoc21.CNC1C(=O)N(C2CC3CCCC2C3)CCc2ncoc21.CNC1C(=O)N(C2CC=CCC2)CCc2ncoc21.CNC1C(=O)N(C2CCC3CC3C2)CCc2ncoc21.CNC1C(=O)N(CC2CC2)CCc2ncoc21.CNC1C(=O)N(CC2CC3CCC(C3)C2)CCc2ncoc21.CNC1C(=O)N(CC2CC3CCCC2C3)CCc2ncoc21.CNC1C(=O)N(CC2CCC2)CCc2ncoc21.CNC1C(=O)N(CC2CCC3CC32)CCc2ncoc21.CSC1C(=O)N(CC2CC3CCC2C3)CCc2ncoc21
• InChI: InChI=1S/2C17H25N3O2.2C16H23N3O2.C16H22N2O2S.4C15H21N3O2.C14H19N3O2.C13H19N3O2.C12H17N3O2/c1-18-15-16-14(19-10-22-16)4-5-20(17(15)21)9-13-7-11-2-3-12(6-11)8-13;1-18-15-16-14(19-10-22-16)5-6-20(17(15)21)9-13-8-11-3-2-4-12(13)7-11;1-17-14-15-13(18-9-21-15)4-5-19(16(14)20)12-7-10-2-3-11(6-10)8-12;1-17-14-15-12(18-9-21-15)5-6-19(16(14)20)13-8-10-3-2-4-11(13)7-10;1-21-15-14-13(17-9-20-14)4-5-18(16(15)19)8-12-7-10-2-3-11(12)6-10;1-16-12-13-11(17-9-20-13)4-7-18(14(12)19)15-5-2-10(8-15)3-6-15;1-16-13-14-12(17-8-20-14)4-5-18(15(13)19)11-3-2-9-6-10(9)7-11;1-16-13-14-12(17-8-20-14)4-5-18(15(13)19)7-10-3-2-9-6-11(9)10;1-16-13-14-11(17-8-20-14)4-5-18(15(13)19)12-7-9-2-3-10(12)6-9;1-15-12-13-11(16-9-19-13)7-8-17(14(12)18)10-5-3-2-4-6-10;1-14-11-12-10(15-8-18-12)5-6-16(13(11)17)7-9-3-2-4-9;1-13-10-11-9(14-7-17-11)4-5-15(12(10)16)6-8-2-3-8/h2*10-13,15,18H,2-9H2,1H3;9-12,14,17H,2-8H2,1H3;9-11,13-14,17H,2-8H2,1H3;9-12,15H,2-8H2,1H3;9-10,12,16H,2-8H2,1H3;2*8-11,13,16H,2-7H2,1H3;8-10,12-13,16H,2-7H2,1H3;2-3,9-10,12,15H,4-8H2,1H3;8-9,11,14H,2-7H2,1H3;7-8,10,13H,2-6H2,1H3
• InChIKey: KXZDKVDTKJWQRJ-UHFFFAOYSA-N
• XLogP: 20.30
• TPSA: 688.41 Ų
• H-Bond Donors: 11
• H-Bond Acceptors: 48
• Rotatable Bonds: 30
• Heavy Atoms: 241
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	3339.33
LogP ≤ 5	20.30
H-Bond Donors ≤ 5	11
H-Bond Acceptors ≤ 10	48

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 6-(1-bicyclo[2.2.1]heptanyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(2-bicyclo[2.2.1]heptanyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(3-bicyclo[4.1.0]heptanyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(2-bicyclo[2.2.1]heptanylmethyl)-8-methylsulfanyl-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(2-bicyclo[3.1.0]hexanylmethyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(3-bicyclo[3.2.1]octanyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(6-bicyclo[3.2.1]octanyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(3-bicyclo[3.2.1]octanylmethyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(6-bicyclo[3.2.1]octanylmethyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(cyclobutylmethyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-cyclohex-3-en-1-yl-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(cyclopropylmethyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one?

The IUPAC name of 6-(1-bicyclo[2.2.1]heptanyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(2-bicyclo[2.2.1]heptanyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(3-bicyclo[4.1.0]heptanyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(2-bicyclo[2.2.1]heptanylmethyl)-8-methylsulfanyl-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(2-bicyclo[3.1.0]hexanylmethyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(3-bicyclo[3.2.1]octanyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(6-bicyclo[3.2.1]octanyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(3-bicyclo[3.2.1]octanylmethyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(6-bicyclo[3.2.1]octanylmethyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(cyclobutylmethyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-cyclohex-3-en-1-yl-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(cyclopropylmethyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one (CID 159273281) is 6-(1-bicyclo[2.2.1]heptanyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(2-bicyclo[2.2.1]heptanyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(3-bicyclo[4.1.0]heptanyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(2-bicyclo[2.2.1]heptanylmethyl)-8-methylsulfanyl-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(2-bicyclo[3.1.0]hexanylmethyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(3-bicyclo[3.2.1]octanyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(6-bicyclo[3.2.1]octanyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(3-bicyclo[3.2.1]octanylmethyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(6-bicyclo[3.2.1]octanylmethyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(cyclobutylmethyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-cyclohex-3-en-1-yl-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(cyclopropylmethyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one.

What is the SMILES notation for 6-(1-bicyclo[2.2.1]heptanyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(2-bicyclo[2.2.1]heptanyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(3-bicyclo[4.1.0]heptanyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(2-bicyclo[2.2.1]heptanylmethyl)-8-methylsulfanyl-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(2-bicyclo[3.1.0]hexanylmethyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(3-bicyclo[3.2.1]octanyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(6-bicyclo[3.2.1]octanyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(3-bicyclo[3.2.1]octanylmethyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(6-bicyclo[3.2.1]octanylmethyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(cyclobutylmethyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-cyclohex-3-en-1-yl-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(cyclopropylmethyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one?

The canonical SMILES for 6-(1-bicyclo[2.2.1]heptanyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(2-bicyclo[2.2.1]heptanyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(3-bicyclo[4.1.0]heptanyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(2-bicyclo[2.2.1]heptanylmethyl)-8-methylsulfanyl-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(2-bicyclo[3.1.0]hexanylmethyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(3-bicyclo[3.2.1]octanyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(6-bicyclo[3.2.1]octanyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(3-bicyclo[3.2.1]octanylmethyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(6-bicyclo[3.2.1]octanylmethyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(cyclobutylmethyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-cyclohex-3-en-1-yl-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(cyclopropylmethyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one is CNC1C(=O)N(C23CCC(CC2)C3)CCc2ncoc21.CNC1C(=O)N(C2CC3CCC(C3)C2)CCc2ncoc21.CNC1C(=O)N(C2CC3CCC2C3)CCc2ncoc21.CNC1C(=O)N(C2CC3CCCC2C3)CCc2ncoc21.CNC1C(=O)N(C2CC=CCC2)CCc2ncoc21.CNC1C(=O)N(C2CCC3CC3C2)CCc2ncoc21.CNC1C(=O)N(CC2CC2)CCc2ncoc21.CNC1C(=O)N(CC2CC3CCC(C3)C2)CCc2ncoc21.CNC1C(=O)N(CC2CC3CCCC2C3)CCc2ncoc21.CNC1C(=O)N(CC2CCC2)CCc2ncoc21.CNC1C(=O)N(CC2CCC3CC32)CCc2ncoc21.CSC1C(=O)N(CC2CC3CCC2C3)CCc2ncoc21.

What is the InChIKey of 6-(1-bicyclo[2.2.1]heptanyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(2-bicyclo[2.2.1]heptanyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(3-bicyclo[4.1.0]heptanyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(2-bicyclo[2.2.1]heptanylmethyl)-8-methylsulfanyl-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(2-bicyclo[3.1.0]hexanylmethyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(3-bicyclo[3.2.1]octanyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(6-bicyclo[3.2.1]octanyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(3-bicyclo[3.2.1]octanylmethyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(6-bicyclo[3.2.1]octanylmethyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(cyclobutylmethyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-cyclohex-3-en-1-yl-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(cyclopropylmethyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one?

The InChIKey is KXZDKVDTKJWQRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/2C17H25N3O2.2C16H23N3O2.C16H22N2O2S.4C15H21N3O2.C14H19N3O2.C13H19N3O2.C12H17N3O2/c1-18-15-16-14(19-10-22-16)4-5-20(17(15)21)9-13-7-11-2-3-12(6-11)8-13;1-18-15-16-14(19-10-22-16)5-6-20(17(15)21)9-13-8-11-3-2-4-12(13)7-11;1-17-14-15-13(18-9-21-15)4-5-19(16(14)20)12-7-10-2-3-11(6-10)8-12;1-17-14-15-12(18-9-21-15)5-6-19(16(14)20)13-8-10-3-2-4-11(13)7-10;1-21-15-14-13(17-9-20-14)4-5-18(16(15)19)8-12-7-10-2-3-11(12)6-10;1-16-12-13-11(17-9-20-13)4-7-18(14(12)19)15-5-2-10(8-15)3-6-15;1-16-13-14-12(17-8-20-14)4-5-18(15(13)19)11-3-2-9-6-10(9)7-11;1-16-13-14-12(17-8-20-14)4-5-18(15(13)19)7-10-3-2-9-6-11(9)10;1-16-13-14-11(17-8-20-14)4-5-18(15(13)19)12-7-9-2-3-10(12)6-9;1-15-12-13-11(16-9-19-13)7-8-17(14(12)18)10-5-3-2-4-6-10;1-14-11-12-10(15-8-18-12)5-6-16(13(11)17)7-9-3-2-4-9;1-13-10-11-9(14-7-17-11)4-5-15(12(10)16)6-8-2-3-8/h2*10-13,15,18H,2-9H2,1H3;9-12,14,17H,2-8H2,1H3;9-11,13-14,17H,2-8H2,1H3;9-12,15H,2-8H2,1H3;9-10,12,16H,2-8H2,1H3;2*8-11,13,16H,2-7H2,1H3;8-10,12-13,16H,2-7H2,1H3;2-3,9-10,12,15H,4-8H2,1H3;8-9,11,14H,2-7H2,1H3;7-8,10,13H,2-6H2,1H3.

What are the key properties of 6-(1-bicyclo[2.2.1]heptanyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(2-bicyclo[2.2.1]heptanyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(3-bicyclo[4.1.0]heptanyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(2-bicyclo[2.2.1]heptanylmethyl)-8-methylsulfanyl-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(2-bicyclo[3.1.0]hexanylmethyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(3-bicyclo[3.2.1]octanyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(6-bicyclo[3.2.1]octanyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(3-bicyclo[3.2.1]octanylmethyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(6-bicyclo[3.2.1]octanylmethyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(cyclobutylmethyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-cyclohex-3-en-1-yl-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(cyclopropylmethyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one?

6-(1-bicyclo[2.2.1]heptanyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(2-bicyclo[2.2.1]heptanyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(3-bicyclo[4.1.0]heptanyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(2-bicyclo[2.2.1]heptanylmethyl)-8-methylsulfanyl-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(2-bicyclo[3.1.0]hexanylmethyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(3-bicyclo[3.2.1]octanyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(6-bicyclo[3.2.1]octanyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(3-bicyclo[3.2.1]octanylmethyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(6-bicyclo[3.2.1]octanylmethyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(cyclobutylmethyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-cyclohex-3-en-1-yl-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(cyclopropylmethyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one has a molecular weight of 3339.33 g/mol, XLogP of 20.30, 30 rotatable bonds, 11 hydrogen bond donors, and 48 hydrogen bond acceptors.

Where does this data come from?

All data for 6-(1-bicyclo[2.2.1]heptanyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(2-bicyclo[2.2.1]heptanyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(3-bicyclo[4.1.0]heptanyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(2-bicyclo[2.2.1]heptanylmethyl)-8-methylsulfanyl-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(2-bicyclo[3.1.0]hexanylmethyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(3-bicyclo[3.2.1]octanyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(6-bicyclo[3.2.1]octanyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(3-bicyclo[3.2.1]octanylmethyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(6-bicyclo[3.2.1]octanylmethyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(cyclobutylmethyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-cyclohex-3-en-1-yl-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one;6-(cyclopropylmethyl)-8-(methylamino)-5,8-dihydro-4H-[1,3]oxazolo[4,5-d]azepin-7-one is sourced from PubChem (CID 159273281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).