N-[(2R)-1-(ethylamino)-1-oxopropan-2-yl]-4-(2-oxopyrrolidin-1-yl)benzamide

C₁₆H₂₁N₃O₃ — CID 8751476

About N-[(2R)-1-(ethylamino)-1-oxopropan-2-yl]-4-(2-oxopyrrolidin-1-yl)benzamide

N-[(2R)-1-(ethylamino)-1-oxopropan-2-yl]-4-(2-oxopyrrolidin-1-yl)benzamide (PubChem CID 8751476) has the molecular formula C₁₆H₂₁N₃O₃ and a molecular weight of 303.36 g/mol. Its IUPAC name is N-[(2R)-1-(ethylamino)-1-oxopropan-2-yl]-4-(2-oxopyrrolidin-1-yl)benzamide.

Molecular Properties

• Compound Name: N-[(2R)-1-(ethylamino)-1-oxopropan-2-yl]-4-(2-oxopyrrolidin-1-yl)benzamide
• PubChem CID: 8751476
• Molecular Formula: C₁₆H₂₁N₃O₃
• Molecular Weight: 303.36 g/mol
• Exact Mass: 303.16
• IUPAC Name: N-[(2R)-1-(ethylamino)-1-oxopropan-2-yl]-4-(2-oxopyrrolidin-1-yl)benzamide
• SMILES: CCNC(=O)[C@@H](C)NC(=O)c1ccc(N2CCCC2=O)cc1
• InChI: InChI=1S/C16H21N3O3/c1-3-17-15(21)11(2)18-16(22)12-6-8-13(9-7-12)19-10-4-5-14(19)20/h6-9,11H,3-5,10H2,1-2H3,(H,17,21)(H,18,22)/t11-/m1/s1
• InChIKey: FPZULYFKLMIXQZ-LLVKDONJSA-N
• XLogP: 1.07
• TPSA: 78.51 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 3
• Rotatable Bonds: 5
• Heavy Atoms: 22
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	303.36
LogP ≤ 5	1.07
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	3

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-1-(ethylamino)-1-oxopropan-2-yl]-4-(2-oxopyrrolidin-1-yl)benzamide?

The IUPAC name of N-[(2R)-1-(ethylamino)-1-oxopropan-2-yl]-4-(2-oxopyrrolidin-1-yl)benzamide (CID 8751476) is N-[(2R)-1-(ethylamino)-1-oxopropan-2-yl]-4-(2-oxopyrrolidin-1-yl)benzamide.

What is the SMILES notation for N-[(2R)-1-(ethylamino)-1-oxopropan-2-yl]-4-(2-oxopyrrolidin-1-yl)benzamide?

The canonical SMILES for N-[(2R)-1-(ethylamino)-1-oxopropan-2-yl]-4-(2-oxopyrrolidin-1-yl)benzamide is CCNC(=O)[C@@H](C)NC(=O)c1ccc(N2CCCC2=O)cc1.

What is the InChIKey of N-[(2R)-1-(ethylamino)-1-oxopropan-2-yl]-4-(2-oxopyrrolidin-1-yl)benzamide?

The InChIKey is FPZULYFKLMIXQZ-LLVKDONJSA-N. The full InChI is InChI=1S/C16H21N3O3/c1-3-17-15(21)11(2)18-16(22)12-6-8-13(9-7-12)19-10-4-5-14(19)20/h6-9,11H,3-5,10H2,1-2H3,(H,17,21)(H,18,22)/t11-/m1/s1.

What are the key properties of N-[(2R)-1-(ethylamino)-1-oxopropan-2-yl]-4-(2-oxopyrrolidin-1-yl)benzamide?

N-[(2R)-1-(ethylamino)-1-oxopropan-2-yl]-4-(2-oxopyrrolidin-1-yl)benzamide has a molecular weight of 303.36 g/mol, XLogP of 1.07, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.

Where does this data come from?

All data for N-[(2R)-1-(ethylamino)-1-oxopropan-2-yl]-4-(2-oxopyrrolidin-1-yl)benzamide is sourced from PubChem (CID 8751476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 8751476 — identifiers, structure, computed properties (public domain)

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