N-(2-methoxyethyl)-2-[[(2S)-2-(4-methylphenoxy)propanoyl]amino]benzamide

C20H24N2O4 — CID 9173265

IUPACN-(2-methoxyethyl)-2-[[(2S)-2-(4-methylphenoxy)propanoyl]amino]benzamide
SMILESCOCCNC(=O)c1ccccc1NC(=O)[C@H](C)Oc1ccc(C)cc1
InChIInChI=1S/C20H24N2O4/c1-14-8-10-16(11-9-14)26-15(2)19(23)22-18-7-5-4-6-17(18)20(24)21-12-13-25-3/h4-11,15H,12-13H2,1-3H3,(H,21,24)(H,22,23)/t15-/m0/s1
InChIKeyHFVODABRYGJNQC-HNNXBMFYSA-N
MW356.42 g/mol
LogP2.78
Rot. Bonds8

About N-(2-methoxyethyl)-2-[[(2S)-2-(4-methylphenoxy)propanoyl]amino]benzamide

N-(2-methoxyethyl)-2-[[(2S)-2-(4-methylphenoxy)propanoyl]amino]benzamide (PubChem CID 9173265) has the molecular formula C20H24N2O4 and a molecular weight of 356.42 g/mol. Its IUPAC name is N-(2-methoxyethyl)-2-[[(2S)-2-(4-methylphenoxy)propanoyl]amino]benzamide.

Molecular Properties

Compound NameN-(2-methoxyethyl)-2-[[(2S)-2-(4-methylphenoxy)propanoyl]amino]benzamide
PubChem CID9173265
Molecular FormulaC20H24N2O4
Molecular Weight356.42 g/mol
Exact Mass356.17
IUPAC NameN-(2-methoxyethyl)-2-[[(2S)-2-(4-methylphenoxy)propanoyl]amino]benzamide
SMILESCOCCNC(=O)c1ccccc1NC(=O)[C@H](C)Oc1ccc(C)cc1
InChIInChI=1S/C20H24N2O4/c1-14-8-10-16(11-9-14)26-15(2)19(23)22-18-7-5-4-6-17(18)20(24)21-12-13-25-3/h4-11,15H,12-13H2,1-3H3,(H,21,24)(H,22,23)/t15-/m0/s1
InChIKeyHFVODABRYGJNQC-HNNXBMFYSA-N
XLogP2.78
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.42
LogP ≤ 52.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-[[(2R)-2-(4-fluorophenoxy)propanoyl]amino]-N-(2-methoxyethyl)benzamide
CID 26076449
2-[2-(4-bromophenoxy)propanoylamino]-N-(2-methoxyethyl)benzamide
CID 132666482
2-[[(2S)-2-(4-chloro-3-methylphenoxy)propanoyl]amino]-N-(2-methoxyethyl)benzamide
CID 94595467
2-[[(2R)-2-(2,4-dimethylphenoxy)propanoyl]amino]-N-(2-methoxyethyl)benzamide
CID 9172865
2-[2-(3-chlorophenoxy)propanoylamino]-N-(2-methoxyethyl)benzamide
CID 43908435
N-[(4-methylphenyl)methyl]-2-(2-phenoxypropanoylamino)benzamide
CID 17320785
(2R)-2-(4-methylphenoxy)-N-[2-[[(2S)-2-(4-methylphenoxy)propanoyl]amino]phenyl]propanamide
CID 1019889
3-[2-(2-methoxyethylcarbamoyl)anilino]-2-methyl-3-oxopropanoic acid
CID 114897363
2-[[(2S)-2-(4-methylphenoxy)propanoyl]amino]benzamide
CID 7371907
2-(2-phenoxypropanoylamino)-N-(2-phenylethyl)benzamide
CID 4939967
N-(2-methoxyethyl)-4-[2-(4-methylphenoxy)propanoylamino]benzamide
CID 17218246
N-(3,4-dimethylphenyl)-2-[2-(4-methylphenoxy)propanoylamino]benzamide
CID 4944490

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-2-[[(2S)-2-(4-methylphenoxy)propanoyl]amino]benzamide?
The IUPAC name of N-(2-methoxyethyl)-2-[[(2S)-2-(4-methylphenoxy)propanoyl]amino]benzamide (CID 9173265) is N-(2-methoxyethyl)-2-[[(2S)-2-(4-methylphenoxy)propanoyl]amino]benzamide.
What is the SMILES notation for N-(2-methoxyethyl)-2-[[(2S)-2-(4-methylphenoxy)propanoyl]amino]benzamide?
The canonical SMILES for N-(2-methoxyethyl)-2-[[(2S)-2-(4-methylphenoxy)propanoyl]amino]benzamide is COCCNC(=O)c1ccccc1NC(=O)[C@H](C)Oc1ccc(C)cc1.
What is the InChIKey of N-(2-methoxyethyl)-2-[[(2S)-2-(4-methylphenoxy)propanoyl]amino]benzamide?
The InChIKey is HFVODABRYGJNQC-HNNXBMFYSA-N. The full InChI is InChI=1S/C20H24N2O4/c1-14-8-10-16(11-9-14)26-15(2)19(23)22-18-7-5-4-6-17(18)20(24)21-12-13-25-3/h4-11,15H,12-13H2,1-3H3,(H,21,24)(H,22,23)/t15-/m0/s1.
What are the key properties of N-(2-methoxyethyl)-2-[[(2S)-2-(4-methylphenoxy)propanoyl]amino]benzamide?
N-(2-methoxyethyl)-2-[[(2S)-2-(4-methylphenoxy)propanoyl]amino]benzamide has a molecular weight of 356.42 g/mol, XLogP of 2.78, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-2-[[(2S)-2-(4-methylphenoxy)propanoyl]amino]benzamide is sourced from PubChem (CID 9173265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).