3-(3,4-difluorophenyl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)propanamide

C₁₉H₁₉F₂NO — CID 46686154

About 3-(3,4-difluorophenyl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)propanamide

3-(3,4-difluorophenyl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)propanamide (PubChem CID 46686154) has the molecular formula C₁₉H₁₉F₂NO and a molecular weight of 315.36 g/mol. Its IUPAC name is 3-(3,4-difluorophenyl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)propanamide.

Molecular Properties

• Compound Name: 3-(3,4-difluorophenyl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)propanamide
• PubChem CID: 46686154
• Molecular Formula: C₁₉H₁₉F₂NO
• Molecular Weight: 315.36 g/mol
• Exact Mass: 315.14
• IUPAC Name: 3-(3,4-difluorophenyl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)propanamide
• SMILES: O=C(CCc1ccc(F)c(F)c1)NC1CCCc2ccccc21
• InChI: InChI=1S/C19H19F2NO/c20-16-10-8-13(12-17(16)21)9-11-19(23)22-18-7-3-5-14-4-1-2-6-15(14)18/h1-2,4,6,8,10,12,18H,3,5,7,9,11H2,(H,22,23)
• InChIKey: OZMNKWSDDMKSQU-UHFFFAOYSA-N
• XLogP: 4.09
• TPSA: 29.10 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 1
• Rotatable Bonds: 4
• Heavy Atoms: 23
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	315.36
LogP ≤ 5	4.09
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	1

Frequently Asked Questions

What is the IUPAC name of 3-(3,4-difluorophenyl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)propanamide?

The IUPAC name of 3-(3,4-difluorophenyl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)propanamide (CID 46686154) is 3-(3,4-difluorophenyl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)propanamide.

What is the SMILES notation for 3-(3,4-difluorophenyl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)propanamide?

The canonical SMILES for 3-(3,4-difluorophenyl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)propanamide is O=C(CCc1ccc(F)c(F)c1)NC1CCCc2ccccc21.

What is the InChIKey of 3-(3,4-difluorophenyl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)propanamide?

The InChIKey is OZMNKWSDDMKSQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19F2NO/c20-16-10-8-13(12-17(16)21)9-11-19(23)22-18-7-3-5-14-4-1-2-6-15(14)18/h1-2,4,6,8,10,12,18H,3,5,7,9,11H2,(H,22,23).

What are the key properties of 3-(3,4-difluorophenyl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)propanamide?

3-(3,4-difluorophenyl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)propanamide has a molecular weight of 315.36 g/mol, XLogP of 4.09, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.

Where does this data come from?

All data for 3-(3,4-difluorophenyl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)propanamide is sourced from PubChem (CID 46686154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 46686154 — identifiers, structure, computed properties (public domain)

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