3-[1-[(3R)-3-aminobutanoyl]piperidin-4-yl]-1-(5-cyclopropyl-1,2-oxazol-3-yl)butan-1-one;3-[1-[(3S)-3-aminobutanoyl]piperidin-4-yl]-1-(5-cyclopropyl-1,2-oxazol-3-yl)butan-1-one;N-[(7S)-7-amino-6-oxooctyl]-5-cyclopropyl-1,2-oxazole-3-carboxamide;N-[cyclohexyl(phenyl)methyl]-5-cyclopropyl-1,2-oxazole-3-carboxamide;5-cyclopropyl-N-(2,2-dimethyl-1-pyridin-3-ylpropyl)-1,2-oxazole-3-carboxamide;5-cyclopropyl-N-[1-(3-fluorophenyl)-2,2-dimethylpropyl]-1,2-oxazole-3-carboxamide

C108H147FN16O15 — CID 159649336

About 3-[1-[(3R)-3-aminobutanoyl]piperidin-4-yl]-1-(5-cyclopropyl-1,2-oxazol-3-yl)butan-1-one;3-[1-[(3S)-3-aminobutanoyl]piperidin-4-yl]-1-(5-cyclopropyl-1,2-oxazol-3-yl)butan-1-one;N-[(7S)-7-amino-6-oxooctyl]-5-cyclopropyl-1,2-oxazole-3-carboxamide;N-[cyclohexyl(phenyl)methyl]-5-cyclopropyl-1,2-oxazole-3-carboxamide;5-cyclopropyl-N-(2,2-dimethyl-1-pyridin-3-ylpropyl)-1,2-oxazole-3-carboxamide;5-cyclopropyl-N-[1-(3-fluorophenyl)-2,2-dimethylpropyl]-1,2-oxazole-3-carboxamide

3-[1-[(3R)-3-aminobutanoyl]piperidin-4-yl]-1-(5-cyclopropyl-1,2-oxazol-3-yl)butan-1-one;3-[1-[(3S)-3-aminobutanoyl]piperidin-4-yl]-1-(5-cyclopropyl-1,2-oxazol-3-yl)butan-1-one;N-[(7S)-7-amino-6-oxooctyl]-5-cyclopropyl-1,2-oxazole-3-carboxamide;N-[cyclohexyl(phenyl)methyl]-5-cyclopropyl-1,2-oxazole-3-carboxamide;5-cyclopropyl-N-(2,2-dimethyl-1-pyridin-3-ylpropyl)-1,2-oxazole-3-carboxamide;5-cyclopropyl-N-[1-(3-fluorophenyl)-2,2-dimethylpropyl]-1,2-oxazole-3-carboxamide (PubChem CID 159649336) has the molecular formula C108H147FN16O15 and a molecular weight of 1928.46 g/mol. Its IUPAC name is 3-[1-[(3R)-3-aminobutanoyl]piperidin-4-yl]-1-(5-cyclopropyl-1,2-oxazol-3-yl)butan-1-one;3-[1-[(3S)-3-aminobutanoyl]piperidin-4-yl]-1-(5-cyclopropyl-1,2-oxazol-3-yl)butan-1-one;N-[(7S)-7-amino-6-oxooctyl]-5-cyclopropyl-1,2-oxazole-3-carboxamide;N-[cyclohexyl(phenyl)methyl]-5-cyclopropyl-1,2-oxazole-3-carboxamide;5-cyclopropyl-N-(2,2-dimethyl-1-pyridin-3-ylpropyl)-1,2-oxazole-3-carboxamide;5-cyclopropyl-N-[1-(3-fluorophenyl)-2,2-dimethylpropyl]-1,2-oxazole-3-carboxamide.

Molecular Properties

• Compound Name: 3-[1-[(3R)-3-aminobutanoyl]piperidin-4-yl]-1-(5-cyclopropyl-1,2-oxazol-3-yl)butan-1-one;3-[1-[(3S)-3-aminobutanoyl]piperidin-4-yl]-1-(5-cyclopropyl-1,2-oxazol-3-yl)butan-1-one;N-[(7S)-7-amino-6-oxooctyl]-5-cyclopropyl-1,2-oxazole-3-carboxamide;N-[cyclohexyl(phenyl)methyl]-5-cyclopropyl-1,2-oxazole-3-carboxamide;5-cyclopropyl-N-(2,2-dimethyl-1-pyridin-3-ylpropyl)-1,2-oxazole-3-carboxamide;5-cyclopropyl-N-[1-(3-fluorophenyl)-2,2-dimethylpropyl]-1,2-oxazole-3-carboxamide
• PubChem CID: 159649336
• Molecular Formula: C108H147FN16O15
• Molecular Weight: 1928.46 g/mol
• Exact Mass: 1927.12
• IUPAC Name: 3-[1-[(3R)-3-aminobutanoyl]piperidin-4-yl]-1-(5-cyclopropyl-1,2-oxazol-3-yl)butan-1-one;3-[1-[(3S)-3-aminobutanoyl]piperidin-4-yl]-1-(5-cyclopropyl-1,2-oxazol-3-yl)butan-1-one;N-[(7S)-7-amino-6-oxooctyl]-5-cyclopropyl-1,2-oxazole-3-carboxamide;N-[cyclohexyl(phenyl)methyl]-5-cyclopropyl-1,2-oxazole-3-carboxamide;5-cyclopropyl-N-(2,2-dimethyl-1-pyridin-3-ylpropyl)-1,2-oxazole-3-carboxamide;5-cyclopropyl-N-[1-(3-fluorophenyl)-2,2-dimethylpropyl]-1,2-oxazole-3-carboxamide
• SMILES: CC(C)(C)C(NC(=O)c1cc(C2CC2)on1)c1cccc(F)c1.CC(C)(C)C(NC(=O)c1cc(C2CC2)on1)c1cccnc1.CC(CC(=O)c1cc(C2CC2)on1)C1CCN(C(=O)C[C@@H](C)N)CC1.CC(CC(=O)c1cc(C2CC2)on1)C1CCN(C(=O)C[C@H](C)N)CC1.C[C@H](N)C(=O)CCCCCNC(=O)c1cc(C2CC2)on1.O=C(NC(c1ccccc1)C1CCCCC1)c1cc(C2CC2)on1
• InChI: InChI=1S/C20H24N2O2.2C19H29N3O3.C18H21FN2O2.C17H21N3O2.C15H23N3O3/c23-20(17-13-18(24-22-17)14-11-12-14)21-19(15-7-3-1-4-8-15)16-9-5-2-6-10-16;2*1-12(9-17(23)16-11-18(25-21-16)15-3-4-15)14-5-7-22(8-6-14)19(24)10-13(2)20;1-18(2,3)16(12-5-4-6-13(19)9-12)20-17(22)14-10-15(23-21-14)11-7-8-11;1-17(2,3)15(12-5-4-8-18-10-12)19-16(21)13-9-14(22-20-13)11-6-7-11;1-10(16)13(19)5-3-2-4-8-17-15(20)12-9-14(21-18-12)11-6-7-11/h1,3-4,7-8,13-14,16,19H,2,5-6,9-12H2,(H,21,23);2*11-15H,3-10,20H2,1-2H3;4-6,9-11,16H,7-8H2,1-3H3,(H,20,22);4-5,8-11,15H,6-7H2,1-3H3,(H,19,21);9-11H,2-8,16H2,1H3,(H,17,20)/t;2*12?,13-;;;10-/m.10..0/s1
• InChIKey: MRJCOMGTJZRKNS-JSEXXIDJSA-N
• XLogP: 19.51
• TPSA: 455.36 Ų
• H-Bond Donors: 7
• H-Bond Acceptors: 25
• Rotatable Bonds: 36
• Heavy Atoms: 140
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1928.46
LogP ≤ 5	19.51
H-Bond Donors ≤ 5	7
H-Bond Acceptors ≤ 10	25

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 3-[1-[(3R)-3-aminobutanoyl]piperidin-4-yl]-1-(5-cyclopropyl-1,2-oxazol-3-yl)butan-1-one;3-[1-[(3S)-3-aminobutanoyl]piperidin-4-yl]-1-(5-cyclopropyl-1,2-oxazol-3-yl)butan-1-one;N-[(7S)-7-amino-6-oxooctyl]-5-cyclopropyl-1,2-oxazole-3-carboxamide;N-[cyclohexyl(phenyl)methyl]-5-cyclopropyl-1,2-oxazole-3-carboxamide;5-cyclopropyl-N-(2,2-dimethyl-1-pyridin-3-ylpropyl)-1,2-oxazole-3-carboxamide;5-cyclopropyl-N-[1-(3-fluorophenyl)-2,2-dimethylpropyl]-1,2-oxazole-3-carboxamide?

The IUPAC name of 3-[1-[(3R)-3-aminobutanoyl]piperidin-4-yl]-1-(5-cyclopropyl-1,2-oxazol-3-yl)butan-1-one;3-[1-[(3S)-3-aminobutanoyl]piperidin-4-yl]-1-(5-cyclopropyl-1,2-oxazol-3-yl)butan-1-one;N-[(7S)-7-amino-6-oxooctyl]-5-cyclopropyl-1,2-oxazole-3-carboxamide;N-[cyclohexyl(phenyl)methyl]-5-cyclopropyl-1,2-oxazole-3-carboxamide;5-cyclopropyl-N-(2,2-dimethyl-1-pyridin-3-ylpropyl)-1,2-oxazole-3-carboxamide;5-cyclopropyl-N-[1-(3-fluorophenyl)-2,2-dimethylpropyl]-1,2-oxazole-3-carboxamide (CID 159649336) is 3-[1-[(3R)-3-aminobutanoyl]piperidin-4-yl]-1-(5-cyclopropyl-1,2-oxazol-3-yl)butan-1-one;3-[1-[(3S)-3-aminobutanoyl]piperidin-4-yl]-1-(5-cyclopropyl-1,2-oxazol-3-yl)butan-1-one;N-[(7S)-7-amino-6-oxooctyl]-5-cyclopropyl-1,2-oxazole-3-carboxamide;N-[cyclohexyl(phenyl)methyl]-5-cyclopropyl-1,2-oxazole-3-carboxamide;5-cyclopropyl-N-(2,2-dimethyl-1-pyridin-3-ylpropyl)-1,2-oxazole-3-carboxamide;5-cyclopropyl-N-[1-(3-fluorophenyl)-2,2-dimethylpropyl]-1,2-oxazole-3-carboxamide.

What is the SMILES notation for 3-[1-[(3R)-3-aminobutanoyl]piperidin-4-yl]-1-(5-cyclopropyl-1,2-oxazol-3-yl)butan-1-one;3-[1-[(3S)-3-aminobutanoyl]piperidin-4-yl]-1-(5-cyclopropyl-1,2-oxazol-3-yl)butan-1-one;N-[(7S)-7-amino-6-oxooctyl]-5-cyclopropyl-1,2-oxazole-3-carboxamide;N-[cyclohexyl(phenyl)methyl]-5-cyclopropyl-1,2-oxazole-3-carboxamide;5-cyclopropyl-N-(2,2-dimethyl-1-pyridin-3-ylpropyl)-1,2-oxazole-3-carboxamide;5-cyclopropyl-N-[1-(3-fluorophenyl)-2,2-dimethylpropyl]-1,2-oxazole-3-carboxamide?

The canonical SMILES for 3-[1-[(3R)-3-aminobutanoyl]piperidin-4-yl]-1-(5-cyclopropyl-1,2-oxazol-3-yl)butan-1-one;3-[1-[(3S)-3-aminobutanoyl]piperidin-4-yl]-1-(5-cyclopropyl-1,2-oxazol-3-yl)butan-1-one;N-[(7S)-7-amino-6-oxooctyl]-5-cyclopropyl-1,2-oxazole-3-carboxamide;N-[cyclohexyl(phenyl)methyl]-5-cyclopropyl-1,2-oxazole-3-carboxamide;5-cyclopropyl-N-(2,2-dimethyl-1-pyridin-3-ylpropyl)-1,2-oxazole-3-carboxamide;5-cyclopropyl-N-[1-(3-fluorophenyl)-2,2-dimethylpropyl]-1,2-oxazole-3-carboxamide is CC(C)(C)C(NC(=O)c1cc(C2CC2)on1)c1cccc(F)c1.CC(C)(C)C(NC(=O)c1cc(C2CC2)on1)c1cccnc1.CC(CC(=O)c1cc(C2CC2)on1)C1CCN(C(=O)C[C@@H](C)N)CC1.CC(CC(=O)c1cc(C2CC2)on1)C1CCN(C(=O)C[C@H](C)N)CC1.C[C@H](N)C(=O)CCCCCNC(=O)c1cc(C2CC2)on1.O=C(NC(c1ccccc1)C1CCCCC1)c1cc(C2CC2)on1.

What is the InChIKey of 3-[1-[(3R)-3-aminobutanoyl]piperidin-4-yl]-1-(5-cyclopropyl-1,2-oxazol-3-yl)butan-1-one;3-[1-[(3S)-3-aminobutanoyl]piperidin-4-yl]-1-(5-cyclopropyl-1,2-oxazol-3-yl)butan-1-one;N-[(7S)-7-amino-6-oxooctyl]-5-cyclopropyl-1,2-oxazole-3-carboxamide;N-[cyclohexyl(phenyl)methyl]-5-cyclopropyl-1,2-oxazole-3-carboxamide;5-cyclopropyl-N-(2,2-dimethyl-1-pyridin-3-ylpropyl)-1,2-oxazole-3-carboxamide;5-cyclopropyl-N-[1-(3-fluorophenyl)-2,2-dimethylpropyl]-1,2-oxazole-3-carboxamide?

The InChIKey is MRJCOMGTJZRKNS-JSEXXIDJSA-N. The full InChI is InChI=1S/C20H24N2O2.2C19H29N3O3.C18H21FN2O2.C17H21N3O2.C15H23N3O3/c23-20(17-13-18(24-22-17)14-11-12-14)21-19(15-7-3-1-4-8-15)16-9-5-2-6-10-16;2*1-12(9-17(23)16-11-18(25-21-16)15-3-4-15)14-5-7-22(8-6-14)19(24)10-13(2)20;1-18(2,3)16(12-5-4-6-13(19)9-12)20-17(22)14-10-15(23-21-14)11-7-8-11;1-17(2,3)15(12-5-4-8-18-10-12)19-16(21)13-9-14(22-20-13)11-6-7-11;1-10(16)13(19)5-3-2-4-8-17-15(20)12-9-14(21-18-12)11-6-7-11/h1,3-4,7-8,13-14,16,19H,2,5-6,9-12H2,(H,21,23);2*11-15H,3-10,20H2,1-2H3;4-6,9-11,16H,7-8H2,1-3H3,(H,20,22);4-5,8-11,15H,6-7H2,1-3H3,(H,19,21);9-11H,2-8,16H2,1H3,(H,17,20)/t;2*12?,13-;;;10-/m.10..0/s1.

What are the key properties of 3-[1-[(3R)-3-aminobutanoyl]piperidin-4-yl]-1-(5-cyclopropyl-1,2-oxazol-3-yl)butan-1-one;3-[1-[(3S)-3-aminobutanoyl]piperidin-4-yl]-1-(5-cyclopropyl-1,2-oxazol-3-yl)butan-1-one;N-[(7S)-7-amino-6-oxooctyl]-5-cyclopropyl-1,2-oxazole-3-carboxamide;N-[cyclohexyl(phenyl)methyl]-5-cyclopropyl-1,2-oxazole-3-carboxamide;5-cyclopropyl-N-(2,2-dimethyl-1-pyridin-3-ylpropyl)-1,2-oxazole-3-carboxamide;5-cyclopropyl-N-[1-(3-fluorophenyl)-2,2-dimethylpropyl]-1,2-oxazole-3-carboxamide?

3-[1-[(3R)-3-aminobutanoyl]piperidin-4-yl]-1-(5-cyclopropyl-1,2-oxazol-3-yl)butan-1-one;3-[1-[(3S)-3-aminobutanoyl]piperidin-4-yl]-1-(5-cyclopropyl-1,2-oxazol-3-yl)butan-1-one;N-[(7S)-7-amino-6-oxooctyl]-5-cyclopropyl-1,2-oxazole-3-carboxamide;N-[cyclohexyl(phenyl)methyl]-5-cyclopropyl-1,2-oxazole-3-carboxamide;5-cyclopropyl-N-(2,2-dimethyl-1-pyridin-3-ylpropyl)-1,2-oxazole-3-carboxamide;5-cyclopropyl-N-[1-(3-fluorophenyl)-2,2-dimethylpropyl]-1,2-oxazole-3-carboxamide has a molecular weight of 1928.46 g/mol, XLogP of 19.51, 36 rotatable bonds, 7 hydrogen bond donors, and 25 hydrogen bond acceptors.

Where does this data come from?

All data for 3-[1-[(3R)-3-aminobutanoyl]piperidin-4-yl]-1-(5-cyclopropyl-1,2-oxazol-3-yl)butan-1-one;3-[1-[(3S)-3-aminobutanoyl]piperidin-4-yl]-1-(5-cyclopropyl-1,2-oxazol-3-yl)butan-1-one;N-[(7S)-7-amino-6-oxooctyl]-5-cyclopropyl-1,2-oxazole-3-carboxamide;N-[cyclohexyl(phenyl)methyl]-5-cyclopropyl-1,2-oxazole-3-carboxamide;5-cyclopropyl-N-(2,2-dimethyl-1-pyridin-3-ylpropyl)-1,2-oxazole-3-carboxamide;5-cyclopropyl-N-[1-(3-fluorophenyl)-2,2-dimethylpropyl]-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 159649336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).