N-(4-acetylphenyl)-4-[(4-chlorophenyl)methoxy]-3-methoxybenzamide

C23H20ClNO4 — CID 2282296

IUPACN-(4-acetylphenyl)-4-[(4-chlorophenyl)methoxy]-3-methoxybenzamide
SMILESCOc1cc(C(=O)Nc2ccc(C(C)=O)cc2)ccc1OCc1ccc(Cl)cc1
InChIInChI=1S/C23H20ClNO4/c1-15(26)17-5-10-20(11-6-17)25-23(27)18-7-12-21(22(13-18)28-2)29-14-16-3-8-19(24)9-4-16/h3-13H,14H2,1-2H3,(H,25,27)
InChIKeyRQPDPHDYHLVYKG-UHFFFAOYSA-N
MW409.87 g/mol
LogP5.38
Rot. Bonds7

About N-(4-acetylphenyl)-4-[(4-chlorophenyl)methoxy]-3-methoxybenzamide

N-(4-acetylphenyl)-4-[(4-chlorophenyl)methoxy]-3-methoxybenzamide (PubChem CID 2282296) has the molecular formula C23H20ClNO4 and a molecular weight of 409.87 g/mol. Its IUPAC name is N-(4-acetylphenyl)-4-[(4-chlorophenyl)methoxy]-3-methoxybenzamide.

Molecular Properties

Compound NameN-(4-acetylphenyl)-4-[(4-chlorophenyl)methoxy]-3-methoxybenzamide
PubChem CID2282296
Molecular FormulaC23H20ClNO4
Molecular Weight409.87 g/mol
Exact Mass409.11
IUPAC NameN-(4-acetylphenyl)-4-[(4-chlorophenyl)methoxy]-3-methoxybenzamide
SMILESCOc1cc(C(=O)Nc2ccc(C(C)=O)cc2)ccc1OCc1ccc(Cl)cc1
InChIInChI=1S/C23H20ClNO4/c1-15(26)17-5-10-20(11-6-17)25-23(27)18-7-12-21(22(13-18)28-2)29-14-16-3-8-19(24)9-4-16/h3-13H,14H2,1-2H3,(H,25,27)
InChIKeyRQPDPHDYHLVYKG-UHFFFAOYSA-N
XLogP5.38
TPSA64.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500409.87
LogP ≤ 55.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-[(4-chlorophenyl)methoxy]-N-[4-(cyanomethyl)phenyl]-3-methoxybenzamide
CID 60599216
4-[(4-chlorophenyl)methoxy]-N-[4-(ethylsulfonylamino)phenyl]-3-methoxybenzamide
CID 55959946
N-(4-bromo-3-methylphenyl)-4-[(4-chlorophenyl)methoxy]-3-methoxybenzamide
CID 3489384
4-[(4-chlorophenyl)methoxy]-3-methoxy-N-(3-methoxyphenyl)benzamide
CID 4614010
4-[(4-chlorophenyl)methoxy]-3-methoxy-N-(2-oxopropyl)benzamide
CID 158622602
N-(1,3-benzodioxol-5-yl)-4-[(4-chlorophenyl)methoxy]-3-methoxybenzamide
CID 26908303
3-methoxy-N-phenyl-4-phenylmethoxybenzamide
CID 5161412
4-[(4-chlorophenyl)methoxy]-3-methoxy-N-pyridin-2-ylbenzamide
CID 43016736
4-[(4-chlorophenyl)methoxy]-3-methoxy-N'-phenylbenzohydrazide
CID 78774841
N-[4-(4-benzylpiperazin-1-yl)phenyl]-4-[(4-chlorophenyl)methoxy]-3-methoxybenzamide
CID 3810040
N-(4-benzoylphenyl)-3-methoxy-4-phenylmethoxybenzamide
CID 139779423
4-[(4-chlorophenyl)methoxy]-3-methoxy-N-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]benzamide
CID 25396665

Frequently Asked Questions

What is the IUPAC name of N-(4-acetylphenyl)-4-[(4-chlorophenyl)methoxy]-3-methoxybenzamide?
The IUPAC name of N-(4-acetylphenyl)-4-[(4-chlorophenyl)methoxy]-3-methoxybenzamide (CID 2282296) is N-(4-acetylphenyl)-4-[(4-chlorophenyl)methoxy]-3-methoxybenzamide.
What is the SMILES notation for N-(4-acetylphenyl)-4-[(4-chlorophenyl)methoxy]-3-methoxybenzamide?
The canonical SMILES for N-(4-acetylphenyl)-4-[(4-chlorophenyl)methoxy]-3-methoxybenzamide is COc1cc(C(=O)Nc2ccc(C(C)=O)cc2)ccc1OCc1ccc(Cl)cc1.
What is the InChIKey of N-(4-acetylphenyl)-4-[(4-chlorophenyl)methoxy]-3-methoxybenzamide?
The InChIKey is RQPDPHDYHLVYKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20ClNO4/c1-15(26)17-5-10-20(11-6-17)25-23(27)18-7-12-21(22(13-18)28-2)29-14-16-3-8-19(24)9-4-16/h3-13H,14H2,1-2H3,(H,25,27).
What are the key properties of N-(4-acetylphenyl)-4-[(4-chlorophenyl)methoxy]-3-methoxybenzamide?
N-(4-acetylphenyl)-4-[(4-chlorophenyl)methoxy]-3-methoxybenzamide has a molecular weight of 409.87 g/mol, XLogP of 5.38, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetylphenyl)-4-[(4-chlorophenyl)methoxy]-3-methoxybenzamide is sourced from PubChem (CID 2282296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).