N-[(1R)-1-cyclopropylethyl]-3-(3-fluorophenyl)-N-methylpropanamide

C₁₅H₂₀FNO — CID 51983037

About N-[(1R)-1-cyclopropylethyl]-3-(3-fluorophenyl)-N-methylpropanamide

N-[(1R)-1-cyclopropylethyl]-3-(3-fluorophenyl)-N-methylpropanamide (PubChem CID 51983037) has the molecular formula C₁₅H₂₀FNO and a molecular weight of 249.33 g/mol. Its IUPAC name is N-[(1R)-1-cyclopropylethyl]-3-(3-fluorophenyl)-N-methylpropanamide.

Molecular Properties

• Compound Name: N-[(1R)-1-cyclopropylethyl]-3-(3-fluorophenyl)-N-methylpropanamide
• PubChem CID: 51983037
• Molecular Formula: C₁₅H₂₀FNO
• Molecular Weight: 249.33 g/mol
• Exact Mass: 249.15
• IUPAC Name: N-[(1R)-1-cyclopropylethyl]-3-(3-fluorophenyl)-N-methylpropanamide
• SMILES: C[C@H](C1CC1)N(C)C(=O)CCc1cccc(F)c1
• InChI: InChI=1S/C15H20FNO/c1-11(13-7-8-13)17(2)15(18)9-6-12-4-3-5-14(16)10-12/h3-5,10-11,13H,6-9H2,1-2H3/t11-/m1/s1
• InChIKey: FLFGOQLJMVNATK-LLVKDONJSA-N
• XLogP: 3.02
• TPSA: 20.31 Ų
• H-Bond Acceptors: 1
• Rotatable Bonds: 5
• Heavy Atoms: 18
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	249.33
LogP ≤ 5	3.02
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	1

Frequently Asked Questions

What is the IUPAC name of N-[(1R)-1-cyclopropylethyl]-3-(3-fluorophenyl)-N-methylpropanamide?

The IUPAC name of N-[(1R)-1-cyclopropylethyl]-3-(3-fluorophenyl)-N-methylpropanamide (CID 51983037) is N-[(1R)-1-cyclopropylethyl]-3-(3-fluorophenyl)-N-methylpropanamide.

What is the SMILES notation for N-[(1R)-1-cyclopropylethyl]-3-(3-fluorophenyl)-N-methylpropanamide?

The canonical SMILES for N-[(1R)-1-cyclopropylethyl]-3-(3-fluorophenyl)-N-methylpropanamide is C[C@H](C1CC1)N(C)C(=O)CCc1cccc(F)c1.

What is the InChIKey of N-[(1R)-1-cyclopropylethyl]-3-(3-fluorophenyl)-N-methylpropanamide?

The InChIKey is FLFGOQLJMVNATK-LLVKDONJSA-N. The full InChI is InChI=1S/C15H20FNO/c1-11(13-7-8-13)17(2)15(18)9-6-12-4-3-5-14(16)10-12/h3-5,10-11,13H,6-9H2,1-2H3/t11-/m1/s1.

What are the key properties of N-[(1R)-1-cyclopropylethyl]-3-(3-fluorophenyl)-N-methylpropanamide?

N-[(1R)-1-cyclopropylethyl]-3-(3-fluorophenyl)-N-methylpropanamide has a molecular weight of 249.33 g/mol, XLogP of 3.02, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.

Where does this data come from?

All data for N-[(1R)-1-cyclopropylethyl]-3-(3-fluorophenyl)-N-methylpropanamide is sourced from PubChem (CID 51983037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 51983037 — identifiers, structure, computed properties (public domain)

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