(3R,4R)-5-(4-chlorophenyl)-3-ethoxy-N-hydroxy-4-(2-propan-2-ylpyrazol-3-yl)pentanamide;(3R,4R)-5-(4-fluoro-2-methylphenyl)-N-hydroxy-3-methoxy-4-(2-propan-2-ylpyrazol-3-yl)pentanamide;(3R,4R)-5-(4-fluoro-3-methylphenyl)-N-hydroxy-3-methoxy-4-(2-propan-2-ylpyrazol-3-yl)pentanamide;(3R,4R)-5-(4-fluorophenyl)-N-hydroxy-3-methoxy-4-(2-propan-2-ylpyrazol-3-yl)pentanamide

C75H102ClF3N12O12 — CID 159616039

About (3R,4R)-5-(4-chlorophenyl)-3-ethoxy-N-hydroxy-4-(2-propan-2-ylpyrazol-3-yl)pentanamide;(3R,4R)-5-(4-fluoro-2-methylphenyl)-N-hydroxy-3-methoxy-4-(2-propan-2-ylpyrazol-3-yl)pentanamide;(3R,4R)-5-(4-fluoro-3-methylphenyl)-N-hydroxy-3-methoxy-4-(2-propan-2-ylpyrazol-3-yl)pentanamide;(3R,4R)-5-(4-fluorophenyl)-N-hydroxy-3-methoxy-4-(2-propan-2-ylpyrazol-3-yl)pentanamide

(3R,4R)-5-(4-chlorophenyl)-3-ethoxy-N-hydroxy-4-(2-propan-2-ylpyrazol-3-yl)pentanamide;(3R,4R)-5-(4-fluoro-2-methylphenyl)-N-hydroxy-3-methoxy-4-(2-propan-2-ylpyrazol-3-yl)pentanamide;(3R,4R)-5-(4-fluoro-3-methylphenyl)-N-hydroxy-3-methoxy-4-(2-propan-2-ylpyrazol-3-yl)pentanamide;(3R,4R)-5-(4-fluorophenyl)-N-hydroxy-3-methoxy-4-(2-propan-2-ylpyrazol-3-yl)pentanamide (PubChem CID 159616039) has the molecular formula C75H102ClF3N12O12 and a molecular weight of 1456.16 g/mol. Its IUPAC name is (3R,4R)-5-(4-chlorophenyl)-3-ethoxy-N-hydroxy-4-(2-propan-2-ylpyrazol-3-yl)pentanamide;(3R,4R)-5-(4-fluoro-2-methylphenyl)-N-hydroxy-3-methoxy-4-(2-propan-2-ylpyrazol-3-yl)pentanamide;(3R,4R)-5-(4-fluoro-3-methylphenyl)-N-hydroxy-3-methoxy-4-(2-propan-2-ylpyrazol-3-yl)pentanamide;(3R,4R)-5-(4-fluorophenyl)-N-hydroxy-3-methoxy-4-(2-propan-2-ylpyrazol-3-yl)pentanamide.

Molecular Properties

• Compound Name: (3R,4R)-5-(4-chlorophenyl)-3-ethoxy-N-hydroxy-4-(2-propan-2-ylpyrazol-3-yl)pentanamide;(3R,4R)-5-(4-fluoro-2-methylphenyl)-N-hydroxy-3-methoxy-4-(2-propan-2-ylpyrazol-3-yl)pentanamide;(3R,4R)-5-(4-fluoro-3-methylphenyl)-N-hydroxy-3-methoxy-4-(2-propan-2-ylpyrazol-3-yl)pentanamide;(3R,4R)-5-(4-fluorophenyl)-N-hydroxy-3-methoxy-4-(2-propan-2-ylpyrazol-3-yl)pentanamide
• PubChem CID: 159616039
• Molecular Formula: C75H102ClF3N12O12
• Molecular Weight: 1456.16 g/mol
• Exact Mass: 1454.74
• IUPAC Name: (3R,4R)-5-(4-chlorophenyl)-3-ethoxy-N-hydroxy-4-(2-propan-2-ylpyrazol-3-yl)pentanamide;(3R,4R)-5-(4-fluoro-2-methylphenyl)-N-hydroxy-3-methoxy-4-(2-propan-2-ylpyrazol-3-yl)pentanamide;(3R,4R)-5-(4-fluoro-3-methylphenyl)-N-hydroxy-3-methoxy-4-(2-propan-2-ylpyrazol-3-yl)pentanamide;(3R,4R)-5-(4-fluorophenyl)-N-hydroxy-3-methoxy-4-(2-propan-2-ylpyrazol-3-yl)pentanamide
• SMILES: CCO[C@H](CC(=O)NO)[C@H](Cc1ccc(Cl)cc1)c1ccnn1C(C)C.CO[C@H](CC(=O)NO)[C@H](Cc1ccc(F)c(C)c1)c1ccnn1C(C)C.CO[C@H](CC(=O)NO)[C@H](Cc1ccc(F)cc1)c1ccnn1C(C)C.CO[C@H](CC(=O)NO)[C@H](Cc1ccc(F)cc1C)c1ccnn1C(C)C
• InChI: InChI=1S/C19H26ClN3O3.2C19H26FN3O3.C18H24FN3O3/c1-4-26-18(12-19(24)22-25)16(11-14-5-7-15(20)8-6-14)17-9-10-21-23(17)13(2)3;1-12(2)23-17(7-8-21-23)16(18(26-4)11-19(24)22-25)10-14-5-6-15(20)9-13(14)3;1-12(2)23-17(7-8-21-23)15(18(26-4)11-19(24)22-25)10-14-5-6-16(20)13(3)9-14;1-12(2)22-16(8-9-20-22)15(17(25-3)11-18(23)21-24)10-13-4-6-14(19)7-5-13/h5-10,13,16,18,25H,4,11-12H2,1-3H3,(H,22,24);5-9,12,16,18,25H,10-11H2,1-4H3,(H,22,24);5-9,12,15,18,25H,10-11H2,1-4H3,(H,22,24);4-9,12,15,17,24H,10-11H2,1-3H3,(H,21,23)/t2*16-,18-;15-,18-;15-,17-/m1111/s1
• InChIKey: MNHKVLAGOVVRHT-HQOONNLKSA-N
• XLogP: 12.88
• TPSA: 305.52 Ų
• H-Bond Donors: 8
• H-Bond Acceptors: 20
• Rotatable Bonds: 33
• Heavy Atoms: 103
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1456.16
LogP ≤ 5	12.88
H-Bond Donors ≤ 5	8
H-Bond Acceptors ≤ 10	20

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of (3R,4R)-5-(4-chlorophenyl)-3-ethoxy-N-hydroxy-4-(2-propan-2-ylpyrazol-3-yl)pentanamide;(3R,4R)-5-(4-fluoro-2-methylphenyl)-N-hydroxy-3-methoxy-4-(2-propan-2-ylpyrazol-3-yl)pentanamide;(3R,4R)-5-(4-fluoro-3-methylphenyl)-N-hydroxy-3-methoxy-4-(2-propan-2-ylpyrazol-3-yl)pentanamide;(3R,4R)-5-(4-fluorophenyl)-N-hydroxy-3-methoxy-4-(2-propan-2-ylpyrazol-3-yl)pentanamide?

The IUPAC name of (3R,4R)-5-(4-chlorophenyl)-3-ethoxy-N-hydroxy-4-(2-propan-2-ylpyrazol-3-yl)pentanamide;(3R,4R)-5-(4-fluoro-2-methylphenyl)-N-hydroxy-3-methoxy-4-(2-propan-2-ylpyrazol-3-yl)pentanamide;(3R,4R)-5-(4-fluoro-3-methylphenyl)-N-hydroxy-3-methoxy-4-(2-propan-2-ylpyrazol-3-yl)pentanamide;(3R,4R)-5-(4-fluorophenyl)-N-hydroxy-3-methoxy-4-(2-propan-2-ylpyrazol-3-yl)pentanamide (CID 159616039) is (3R,4R)-5-(4-chlorophenyl)-3-ethoxy-N-hydroxy-4-(2-propan-2-ylpyrazol-3-yl)pentanamide;(3R,4R)-5-(4-fluoro-2-methylphenyl)-N-hydroxy-3-methoxy-4-(2-propan-2-ylpyrazol-3-yl)pentanamide;(3R,4R)-5-(4-fluoro-3-methylphenyl)-N-hydroxy-3-methoxy-4-(2-propan-2-ylpyrazol-3-yl)pentanamide;(3R,4R)-5-(4-fluorophenyl)-N-hydroxy-3-methoxy-4-(2-propan-2-ylpyrazol-3-yl)pentanamide.

What is the SMILES notation for (3R,4R)-5-(4-chlorophenyl)-3-ethoxy-N-hydroxy-4-(2-propan-2-ylpyrazol-3-yl)pentanamide;(3R,4R)-5-(4-fluoro-2-methylphenyl)-N-hydroxy-3-methoxy-4-(2-propan-2-ylpyrazol-3-yl)pentanamide;(3R,4R)-5-(4-fluoro-3-methylphenyl)-N-hydroxy-3-methoxy-4-(2-propan-2-ylpyrazol-3-yl)pentanamide;(3R,4R)-5-(4-fluorophenyl)-N-hydroxy-3-methoxy-4-(2-propan-2-ylpyrazol-3-yl)pentanamide?

The canonical SMILES for (3R,4R)-5-(4-chlorophenyl)-3-ethoxy-N-hydroxy-4-(2-propan-2-ylpyrazol-3-yl)pentanamide;(3R,4R)-5-(4-fluoro-2-methylphenyl)-N-hydroxy-3-methoxy-4-(2-propan-2-ylpyrazol-3-yl)pentanamide;(3R,4R)-5-(4-fluoro-3-methylphenyl)-N-hydroxy-3-methoxy-4-(2-propan-2-ylpyrazol-3-yl)pentanamide;(3R,4R)-5-(4-fluorophenyl)-N-hydroxy-3-methoxy-4-(2-propan-2-ylpyrazol-3-yl)pentanamide is CCO[C@H](CC(=O)NO)[C@H](Cc1ccc(Cl)cc1)c1ccnn1C(C)C.CO[C@H](CC(=O)NO)[C@H](Cc1ccc(F)c(C)c1)c1ccnn1C(C)C.CO[C@H](CC(=O)NO)[C@H](Cc1ccc(F)cc1)c1ccnn1C(C)C.CO[C@H](CC(=O)NO)[C@H](Cc1ccc(F)cc1C)c1ccnn1C(C)C.

What is the InChIKey of (3R,4R)-5-(4-chlorophenyl)-3-ethoxy-N-hydroxy-4-(2-propan-2-ylpyrazol-3-yl)pentanamide;(3R,4R)-5-(4-fluoro-2-methylphenyl)-N-hydroxy-3-methoxy-4-(2-propan-2-ylpyrazol-3-yl)pentanamide;(3R,4R)-5-(4-fluoro-3-methylphenyl)-N-hydroxy-3-methoxy-4-(2-propan-2-ylpyrazol-3-yl)pentanamide;(3R,4R)-5-(4-fluorophenyl)-N-hydroxy-3-methoxy-4-(2-propan-2-ylpyrazol-3-yl)pentanamide?

The InChIKey is MNHKVLAGOVVRHT-HQOONNLKSA-N. The full InChI is InChI=1S/C19H26ClN3O3.2C19H26FN3O3.C18H24FN3O3/c1-4-26-18(12-19(24)22-25)16(11-14-5-7-15(20)8-6-14)17-9-10-21-23(17)13(2)3;1-12(2)23-17(7-8-21-23)16(18(26-4)11-19(24)22-25)10-14-5-6-15(20)9-13(14)3;1-12(2)23-17(7-8-21-23)15(18(26-4)11-19(24)22-25)10-14-5-6-16(20)13(3)9-14;1-12(2)22-16(8-9-20-22)15(17(25-3)11-18(23)21-24)10-13-4-6-14(19)7-5-13/h5-10,13,16,18,25H,4,11-12H2,1-3H3,(H,22,24);5-9,12,16,18,25H,10-11H2,1-4H3,(H,22,24);5-9,12,15,18,25H,10-11H2,1-4H3,(H,22,24);4-9,12,15,17,24H,10-11H2,1-3H3,(H,21,23)/t2*16-,18-;15-,18-;15-,17-/m1111/s1.

What are the key properties of (3R,4R)-5-(4-chlorophenyl)-3-ethoxy-N-hydroxy-4-(2-propan-2-ylpyrazol-3-yl)pentanamide;(3R,4R)-5-(4-fluoro-2-methylphenyl)-N-hydroxy-3-methoxy-4-(2-propan-2-ylpyrazol-3-yl)pentanamide;(3R,4R)-5-(4-fluoro-3-methylphenyl)-N-hydroxy-3-methoxy-4-(2-propan-2-ylpyrazol-3-yl)pentanamide;(3R,4R)-5-(4-fluorophenyl)-N-hydroxy-3-methoxy-4-(2-propan-2-ylpyrazol-3-yl)pentanamide?

(3R,4R)-5-(4-chlorophenyl)-3-ethoxy-N-hydroxy-4-(2-propan-2-ylpyrazol-3-yl)pentanamide;(3R,4R)-5-(4-fluoro-2-methylphenyl)-N-hydroxy-3-methoxy-4-(2-propan-2-ylpyrazol-3-yl)pentanamide;(3R,4R)-5-(4-fluoro-3-methylphenyl)-N-hydroxy-3-methoxy-4-(2-propan-2-ylpyrazol-3-yl)pentanamide;(3R,4R)-5-(4-fluorophenyl)-N-hydroxy-3-methoxy-4-(2-propan-2-ylpyrazol-3-yl)pentanamide has a molecular weight of 1456.16 g/mol, XLogP of 12.88, 33 rotatable bonds, 8 hydrogen bond donors, and 20 hydrogen bond acceptors.

Where does this data come from?

All data for (3R,4R)-5-(4-chlorophenyl)-3-ethoxy-N-hydroxy-4-(2-propan-2-ylpyrazol-3-yl)pentanamide;(3R,4R)-5-(4-fluoro-2-methylphenyl)-N-hydroxy-3-methoxy-4-(2-propan-2-ylpyrazol-3-yl)pentanamide;(3R,4R)-5-(4-fluoro-3-methylphenyl)-N-hydroxy-3-methoxy-4-(2-propan-2-ylpyrazol-3-yl)pentanamide;(3R,4R)-5-(4-fluorophenyl)-N-hydroxy-3-methoxy-4-(2-propan-2-ylpyrazol-3-yl)pentanamide is sourced from PubChem (CID 159616039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).