4-methoxy-N-[2-(2-phenoxypropanoylamino)phenyl]benzamide

C23H22N2O4 — CID 17380470

IUPAC4-methoxy-N-[2-(2-phenoxypropanoylamino)phenyl]benzamide
SMILESCOc1ccc(C(=O)Nc2ccccc2NC(=O)C(C)Oc2ccccc2)cc1
InChIInChI=1S/C23H22N2O4/c1-16(29-19-8-4-3-5-9-19)22(26)24-20-10-6-7-11-21(20)25-23(27)17-12-14-18(28-2)15-13-17/h3-16H,1-2H3,(H,24,26)(H,25,27)
InChIKeyYXSMCAGQFVOEEZ-UHFFFAOYSA-N
MW390.44 g/mol
LogP4.35
Rot. Bonds7

About 4-methoxy-N-[2-(2-phenoxypropanoylamino)phenyl]benzamide

4-methoxy-N-[2-(2-phenoxypropanoylamino)phenyl]benzamide (PubChem CID 17380470) has the molecular formula C23H22N2O4 and a molecular weight of 390.44 g/mol. Its IUPAC name is 4-methoxy-N-[2-(2-phenoxypropanoylamino)phenyl]benzamide.

Molecular Properties

Compound Name4-methoxy-N-[2-(2-phenoxypropanoylamino)phenyl]benzamide
PubChem CID17380470
Molecular FormulaC23H22N2O4
Molecular Weight390.44 g/mol
Exact Mass390.16
IUPAC Name4-methoxy-N-[2-(2-phenoxypropanoylamino)phenyl]benzamide
SMILESCOc1ccc(C(=O)Nc2ccccc2NC(=O)C(C)Oc2ccccc2)cc1
InChIInChI=1S/C23H22N2O4/c1-16(29-19-8-4-3-5-9-19)22(26)24-20-10-6-7-11-21(20)25-23(27)17-12-14-18(28-2)15-13-17/h3-16H,1-2H3,(H,24,26)(H,25,27)
InChIKeyYXSMCAGQFVOEEZ-UHFFFAOYSA-N
XLogP4.35
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.44
LogP ≤ 54.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-methoxyphenyl)-4-[(2R)-1-(2-methylanilino)-1-oxopropan-2-yl]oxybenzamide
CID 7709088
(2S)-2-(4-methoxyphenoxy)-N-(2-phenoxyphenyl)propanamide
CID 42093263
2-(4-methoxyphenoxy)-N-(2-phenoxyphenyl)propanamide
CID 18837904
4-[2-(4-methoxyphenoxy)propanoylamino]-N-(4-methoxyphenyl)benzamide
CID 55504736
(2R)-2-(4-methoxyphenoxy)-N-(2-methoxyphenyl)propanamide
CID 925101
N-(2-benzoylphenyl)-2-(4-methoxyphenoxy)propanamide
CID 132656400
methyl 2-[[(2S)-2-(4-methoxyphenoxy)propanoyl]amino]benzoate
CID 719429
(2R)-N-(2-iodophenyl)-2-phenoxypropanamide
CID 1124071
4-[(2S)-1-(4-fluoroanilino)-1-oxopropan-2-yl]oxy-N-(2-methoxyphenyl)benzamide
CID 1179494
(2R)-2-(4-methylphenoxy)-N-[2-[[(2S)-2-(4-methylphenoxy)propanoyl]amino]phenyl]propanamide
CID 1019889
2-(4-methoxyphenoxy)-N-(4-phenoxyphenyl)propanamide
CID 2952537
N-[4-[2-(4-ethylphenoxy)propanoylamino]-2,5-dimethoxyphenyl]benzamide
CID 53266069

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-[2-(2-phenoxypropanoylamino)phenyl]benzamide?
The IUPAC name of 4-methoxy-N-[2-(2-phenoxypropanoylamino)phenyl]benzamide (CID 17380470) is 4-methoxy-N-[2-(2-phenoxypropanoylamino)phenyl]benzamide.
What is the SMILES notation for 4-methoxy-N-[2-(2-phenoxypropanoylamino)phenyl]benzamide?
The canonical SMILES for 4-methoxy-N-[2-(2-phenoxypropanoylamino)phenyl]benzamide is COc1ccc(C(=O)Nc2ccccc2NC(=O)C(C)Oc2ccccc2)cc1.
What is the InChIKey of 4-methoxy-N-[2-(2-phenoxypropanoylamino)phenyl]benzamide?
The InChIKey is YXSMCAGQFVOEEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22N2O4/c1-16(29-19-8-4-3-5-9-19)22(26)24-20-10-6-7-11-21(20)25-23(27)17-12-14-18(28-2)15-13-17/h3-16H,1-2H3,(H,24,26)(H,25,27).
What are the key properties of 4-methoxy-N-[2-(2-phenoxypropanoylamino)phenyl]benzamide?
4-methoxy-N-[2-(2-phenoxypropanoylamino)phenyl]benzamide has a molecular weight of 390.44 g/mol, XLogP of 4.35, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-[2-(2-phenoxypropanoylamino)phenyl]benzamide is sourced from PubChem (CID 17380470), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).