3,4-diphenyl-N-[(2R)-5-pyridin-3-ylpentan-2-yl]benzamide

C₂₉H₂₈N₂O — CID 14570092

About 3,4-diphenyl-N-[(2R)-5-pyridin-3-ylpentan-2-yl]benzamide

3,4-diphenyl-N-[(2R)-5-pyridin-3-ylpentan-2-yl]benzamide (PubChem CID 14570092) has the molecular formula C₂₉H₂₈N₂O and a molecular weight of 420.56 g/mol. Its IUPAC name is 3,4-diphenyl-N-[(2R)-5-pyridin-3-ylpentan-2-yl]benzamide.

Molecular Properties

• Compound Name: 3,4-diphenyl-N-[(2R)-5-pyridin-3-ylpentan-2-yl]benzamide
• PubChem CID: 14570092
• Molecular Formula: C₂₉H₂₈N₂O
• Molecular Weight: 420.56 g/mol
• Exact Mass: 420.22
• IUPAC Name: 3,4-diphenyl-N-[(2R)-5-pyridin-3-ylpentan-2-yl]benzamide
• SMILES: C[C@H](CCCc1cccnc1)NC(=O)c1ccc(-c2ccccc2)c(-c2ccccc2)c1
• InChI: InChI=1S/C29H28N2O/c1-22(10-8-11-23-12-9-19-30-21-23)31-29(32)26-17-18-27(24-13-4-2-5-14-24)28(20-26)25-15-6-3-7-16-25/h2-7,9,12-22H,8,10-11H2,1H3,(H,31,32)/t22-/m1/s1
• InChIKey: RWQUNPYXECPYEB-JOCHJYFZSA-N
• XLogP: 6.56
• TPSA: 41.99 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 2
• Rotatable Bonds: 8
• Heavy Atoms: 32
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	420.56
LogP ≤ 5	6.56
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	2

Frequently Asked Questions

What is the IUPAC name of 3,4-diphenyl-N-[(2R)-5-pyridin-3-ylpentan-2-yl]benzamide?

The IUPAC name of 3,4-diphenyl-N-[(2R)-5-pyridin-3-ylpentan-2-yl]benzamide (CID 14570092) is 3,4-diphenyl-N-[(2R)-5-pyridin-3-ylpentan-2-yl]benzamide.

What is the SMILES notation for 3,4-diphenyl-N-[(2R)-5-pyridin-3-ylpentan-2-yl]benzamide?

The canonical SMILES for 3,4-diphenyl-N-[(2R)-5-pyridin-3-ylpentan-2-yl]benzamide is C[C@H](CCCc1cccnc1)NC(=O)c1ccc(-c2ccccc2)c(-c2ccccc2)c1.

What is the InChIKey of 3,4-diphenyl-N-[(2R)-5-pyridin-3-ylpentan-2-yl]benzamide?

The InChIKey is RWQUNPYXECPYEB-JOCHJYFZSA-N. The full InChI is InChI=1S/C29H28N2O/c1-22(10-8-11-23-12-9-19-30-21-23)31-29(32)26-17-18-27(24-13-4-2-5-14-24)28(20-26)25-15-6-3-7-16-25/h2-7,9,12-22H,8,10-11H2,1H3,(H,31,32)/t22-/m1/s1.

What are the key properties of 3,4-diphenyl-N-[(2R)-5-pyridin-3-ylpentan-2-yl]benzamide?

3,4-diphenyl-N-[(2R)-5-pyridin-3-ylpentan-2-yl]benzamide has a molecular weight of 420.56 g/mol, XLogP of 6.56, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.

Where does this data come from?

All data for 3,4-diphenyl-N-[(2R)-5-pyridin-3-ylpentan-2-yl]benzamide is sourced from PubChem (CID 14570092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 14570092 — identifiers, structure, computed properties (public domain)

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