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

C21H20FN3O2 — CID 163231705

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 Name5-[(2-aminoacetyl)amino]-2-fluoro-N-[(1R)-1-naphthalen-1-ylethyl]benzamide
PubChem CID163231705
Molecular FormulaC21H20FN3O2
Molecular Weight365.41 g/mol
Exact Mass365.15
IUPAC Name5-[(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
XLogP3.37
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.41
LogP ≤ 53.37
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-(4-aminobutanoylamino)-2-methyl-N-[(1R)-1-naphthalen-1-ylethyl]benzamide
CID 163231625
5-[[(2S)-2,3-diaminopropanoyl]amino]-2-methyl-N-[(1S)-1-naphthalen-1-ylethyl]benzamide
CID 163231879
N-(1-naphthalen-1-ylethyl)naphthalene-1-carboxamide
CID 593320
5-[[(2S)-2,3-diaminopropyl]amino]-2-methyl-N-[(1R)-1-naphthalen-1-ylethyl]benzamide;bis(2,2,2-trifluoroacetic acid)
CID 175710928
2-amino-N-[(1R)-1-naphthalen-1-ylethyl]benzamide
CID 131858457
2-(2-aminoethyl)-N-(1-naphthalen-1-ylethyl)benzamide;hydrochloride
CID 170337610
5-(benzylcarbamoylamino)-2-methyl-N-[(1R)-1-naphthalen-1-ylethyl]benzamide
CID 163231845
5-[[(2R)-2,3-diaminopropanoyl]amino]-2-(methylamino)-N-[(1R)-1-naphthalen-1-ylethyl]benzamide;2,2,2-trifluoroacetic acid
CID 175710903
5-[(2-amino-2-methylpropyl)amino]-2-methyl-N-[(1R)-1-naphthalen-1-ylethyl]benzamide;bis(2,2,2-trifluoroacetic acid)
CID 175710888
2-[[(1R)-1-naphthalen-1-ylethyl]carbamoyl]benzoic acid
CID 853685
[2-(3,4-difluoroanilino)-2-oxoethyl]-[(1S)-1-naphthalen-1-ylethyl]azanium
CID 9396987
5-[[(2S)-2-(dimethylamino)-3-hydroxypropanoyl]amino]-2-methyl-N-[(1R)-1-naphthalen-1-ylethyl]benzamide
CID 163231801

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).