5-[(2-aminoacetyl)amino]-2-fluoro-N-[(1R)-1-naphthalen-1-ylethyl]benzamide

Name: 5-[(2-aminoacetyl)amino]-2-fluoro-N-[(1R)-1-naphthalen-1-ylethyl]benzamide — Molecular Data
Creator: MolForge
License: https://creativecommons.org/publicdomain/zero/1.0/

C₂₁H₂₀FN₃O₂ — CID 163231705

Data last refreshed: 2026-04-15 (MolForge compound catalog, from PubChem)

IUPAC5-[(2-aminoacetyl)amino]-2-fluoro-N-[(1R)-1-naphthalen-1-ylethyl]benzamide

SMILESC[C@@H](NC(=O)c1cc(NC(=O)CN)ccc1F)c1cccc2ccccc12

InChIInChI=1S/C21H20FN3O2/c1-13(16-8-4-6-14-5-2-3-7-17(14)16)24-21(27)18-11-15(9-10-19(18)22)25-20(26)12-23/h2-11,13H,12,23H2,1H3,(H,24,27)(H,25,26)/t13-/m1/s1

InChIKeyFWUZRCKJAIJLHB-CYBMUJFWSA-N

MW365.41 g/mol

LogP3.37

Rot. Bonds5

About 5-[(2-aminoacetyl)amino]-2-fluoro-N-[(1R)-1-naphthalen-1-ylethyl]benzamide

5-[(2-aminoacetyl)amino]-2-fluoro-N-[(1R)-1-naphthalen-1-ylethyl]benzamide (PubChem CID 163231705) has the molecular formula C₂₁H₂₀FN₃O₂ and a molecular weight of 365.41 g/mol. Its IUPAC name is 5-[(2-aminoacetyl)amino]-2-fluoro-N-[(1R)-1-naphthalen-1-ylethyl]benzamide.

Molecular Properties

Compound Name	5-[(2-aminoacetyl)amino]-2-fluoro-N-[(1R)-1-naphthalen-1-ylethyl]benzamide
PubChem CID	163231705
Molecular Formula	C₂₁H₂₀FN₃O₂
Molecular Weight	365.41 g/mol
Exact Mass	365.15
IUPAC Name	5-[(2-aminoacetyl)amino]-2-fluoro-N-[(1R)-1-naphthalen-1-ylethyl]benzamide
SMILES	C[C@@H](NC(=O)c1cc(NC(=O)CN)ccc1F)c1cccc2ccccc12
InChI	InChI=1S/C21H20FN3O2/c1-13(16-8-4-6-14-5-2-3-7-17(14)16)24-21(27)18-11-15(9-10-19(18)22)25-20(26)12-23/h2-11,13H,12,23H2,1H3,(H,24,27)(H,25,26)/t13-/m1/s1
InChIKey	FWUZRCKJAIJLHB-CYBMUJFWSA-N
XLogP	3.37
TPSA	84.22 Å²
H-Bond Donors	3
H-Bond Acceptors	3
Rotatable Bonds	5
Heavy Atoms	27
Complexity	—

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	365.41
LogP ≤ 5	3.37
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	3

Frequently Asked Questions

What is the IUPAC name of 5-[(2-aminoacetyl)amino]-2-fluoro-N-[(1R)-1-naphthalen-1-ylethyl]benzamide?

The IUPAC name of 5-[(2-aminoacetyl)amino]-2-fluoro-N-[(1R)-1-naphthalen-1-ylethyl]benzamide (CID 163231705) is 5-[(2-aminoacetyl)amino]-2-fluoro-N-[(1R)-1-naphthalen-1-ylethyl]benzamide.

What is the SMILES notation for 5-[(2-aminoacetyl)amino]-2-fluoro-N-[(1R)-1-naphthalen-1-ylethyl]benzamide?

The canonical SMILES for 5-[(2-aminoacetyl)amino]-2-fluoro-N-[(1R)-1-naphthalen-1-ylethyl]benzamide is C[C@@H](NC(=O)c1cc(NC(=O)CN)ccc1F)c1cccc2ccccc12.

What is the InChIKey of 5-[(2-aminoacetyl)amino]-2-fluoro-N-[(1R)-1-naphthalen-1-ylethyl]benzamide?

The InChIKey is FWUZRCKJAIJLHB-CYBMUJFWSA-N. The full InChI is InChI=1S/C21H20FN3O2/c1-13(16-8-4-6-14-5-2-3-7-17(14)16)24-21(27)18-11-15(9-10-19(18)22)25-20(26)12-23/h2-11,13H,12,23H2,1H3,(H,24,27)(H,25,26)/t13-/m1/s1.

What are the key properties of 5-[(2-aminoacetyl)amino]-2-fluoro-N-[(1R)-1-naphthalen-1-ylethyl]benzamide?

5-[(2-aminoacetyl)amino]-2-fluoro-N-[(1R)-1-naphthalen-1-ylethyl]benzamide has a molecular weight of 365.41 g/mol, XLogP of 3.37, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.

Where does this data come from?

All data for 5-[(2-aminoacetyl)amino]-2-fluoro-N-[(1R)-1-naphthalen-1-ylethyl]benzamide is sourced from PubChem (CID 163231705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

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Sources

PubChem CID 163231705 — identifiers, structure, computed properties (public domain)

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