4-[[(2R)-2-(4-chlorophenoxy)propanoyl]amino]benzamide

C16H15ClN2O3 — CID 7816278

IUPAC4-[[(2R)-2-(4-chlorophenoxy)propanoyl]amino]benzamide
SMILESC[C@@H](Oc1ccc(Cl)cc1)C(=O)Nc1ccc(C(N)=O)cc1
InChIInChI=1S/C16H15ClN2O3/c1-10(22-14-8-4-12(17)5-9-14)16(21)19-13-6-2-11(3-7-13)15(18)20/h2-10H,1H3,(H2,18,20)(H,19,21)/t10-/m1/s1
InChIKeyZYBWYFVUVSNISR-SNVBAGLBSA-N
MW318.76 g/mol
LogP2.84
Rot. Bonds5

About 4-[[(2R)-2-(4-chlorophenoxy)propanoyl]amino]benzamide

4-[[(2R)-2-(4-chlorophenoxy)propanoyl]amino]benzamide (PubChem CID 7816278) has the molecular formula C16H15ClN2O3 and a molecular weight of 318.76 g/mol. Its IUPAC name is 4-[[(2R)-2-(4-chlorophenoxy)propanoyl]amino]benzamide.

Molecular Properties

Compound Name4-[[(2R)-2-(4-chlorophenoxy)propanoyl]amino]benzamide
PubChem CID7816278
Molecular FormulaC16H15ClN2O3
Molecular Weight318.76 g/mol
Exact Mass318.08
IUPAC Name4-[[(2R)-2-(4-chlorophenoxy)propanoyl]amino]benzamide
SMILESC[C@@H](Oc1ccc(Cl)cc1)C(=O)Nc1ccc(C(N)=O)cc1
InChIInChI=1S/C16H15ClN2O3/c1-10(22-14-8-4-12(17)5-9-14)16(21)19-13-6-2-11(3-7-13)15(18)20/h2-10H,1H3,(H2,18,20)(H,19,21)/t10-/m1/s1
InChIKeyZYBWYFVUVSNISR-SNVBAGLBSA-N
XLogP2.84
TPSA81.42 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.76
LogP ≤ 52.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-[[(2S)-2-(3-chloro-4-fluorophenoxy)propanoyl]amino]benzamide
CID 7751173
4-[2-(4-methoxyphenoxy)propanoylamino]benzamide
CID 2952411
N-(4-acetamidophenyl)-2-(4-chlorophenoxy)propanamide
CID 4943851
methyl 4-[(2S)-1-(4-carbamoylanilino)-1-oxopropan-2-yl]oxybenzoate
CID 7667506
4-[(2S)-1-(4-fluoroanilino)-1-oxopropan-2-yl]oxybenzamide
CID 7931427
N-[4-[2-(4-chlorophenoxy)propanoylamino]phenyl]-2-methylpropanamide
CID 17187935
2-(4-chlorophenoxy)-N-phenylpropanamide
CID 4943865
2-(4-chlorophenoxy)-N-(4-methylphenyl)propanamide
CID 4943921
N-(4-chlorophenyl)-2-(4-methoxyphenoxy)propanamide
CID 2789590
4-[[(2S)-2-(4-phenylphenoxy)propanoyl]amino]benzamide
CID 1177972
N-(4-acetylphenyl)-2-[4-(4-chlorobenzoyl)phenoxy]propanamide
CID 4884528
2-(4-chlorophenoxy)-N-[4-[[4-[2-(4-chlorophenoxy)propanoylamino]phenyl]methyl]phenyl]propanamide
CID 4944300

Frequently Asked Questions

What is the IUPAC name of 4-[[(2R)-2-(4-chlorophenoxy)propanoyl]amino]benzamide?
The IUPAC name of 4-[[(2R)-2-(4-chlorophenoxy)propanoyl]amino]benzamide (CID 7816278) is 4-[[(2R)-2-(4-chlorophenoxy)propanoyl]amino]benzamide.
What is the SMILES notation for 4-[[(2R)-2-(4-chlorophenoxy)propanoyl]amino]benzamide?
The canonical SMILES for 4-[[(2R)-2-(4-chlorophenoxy)propanoyl]amino]benzamide is C[C@@H](Oc1ccc(Cl)cc1)C(=O)Nc1ccc(C(N)=O)cc1.
What is the InChIKey of 4-[[(2R)-2-(4-chlorophenoxy)propanoyl]amino]benzamide?
The InChIKey is ZYBWYFVUVSNISR-SNVBAGLBSA-N. The full InChI is InChI=1S/C16H15ClN2O3/c1-10(22-14-8-4-12(17)5-9-14)16(21)19-13-6-2-11(3-7-13)15(18)20/h2-10H,1H3,(H2,18,20)(H,19,21)/t10-/m1/s1.
What are the key properties of 4-[[(2R)-2-(4-chlorophenoxy)propanoyl]amino]benzamide?
4-[[(2R)-2-(4-chlorophenoxy)propanoyl]amino]benzamide has a molecular weight of 318.76 g/mol, XLogP of 2.84, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[(2R)-2-(4-chlorophenoxy)propanoyl]amino]benzamide is sourced from PubChem (CID 7816278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).