N-(3-acetamido-4-methoxyphenyl)-4-butylbenzamide

C20H24N2O3 — CID 24666778

IUPACN-(3-acetamido-4-methoxyphenyl)-4-butylbenzamide
SMILESCCCCc1ccc(C(=O)Nc2ccc(OC)c(NC(C)=O)c2)cc1
InChIInChI=1S/C20H24N2O3/c1-4-5-6-15-7-9-16(10-8-15)20(24)22-17-11-12-19(25-3)18(13-17)21-14(2)23/h7-13H,4-6H2,1-3H3,(H,21,23)(H,22,24)
InChIKeyJHRCRUUIIPYAKN-UHFFFAOYSA-N
MW340.42 g/mol
LogP4.25
Rot. Bonds7

About N-(3-acetamido-4-methoxyphenyl)-4-butylbenzamide

N-(3-acetamido-4-methoxyphenyl)-4-butylbenzamide (PubChem CID 24666778) has the molecular formula C20H24N2O3 and a molecular weight of 340.42 g/mol. Its IUPAC name is N-(3-acetamido-4-methoxyphenyl)-4-butylbenzamide.

Molecular Properties

Compound NameN-(3-acetamido-4-methoxyphenyl)-4-butylbenzamide
PubChem CID24666778
Molecular FormulaC20H24N2O3
Molecular Weight340.42 g/mol
Exact Mass340.18
IUPAC NameN-(3-acetamido-4-methoxyphenyl)-4-butylbenzamide
SMILESCCCCc1ccc(C(=O)Nc2ccc(OC)c(NC(C)=O)c2)cc1
InChIInChI=1S/C20H24N2O3/c1-4-5-6-15-7-9-16(10-8-15)20(24)22-17-11-12-19(25-3)18(13-17)21-14(2)23/h7-13H,4-6H2,1-3H3,(H,21,23)(H,22,24)
InChIKeyJHRCRUUIIPYAKN-UHFFFAOYSA-N
XLogP4.25
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.42
LogP ≤ 54.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-butylphenyl)-4-methoxy-3-nitrobenzamide
CID 3346211
N-(3-acetamido-4-methoxyphenyl)-4-(cyclopropanecarbonylamino)benzamide
CID 35347425
N-(3-acetamido-4-methoxyphenyl)-4-(trifluoromethylsulfanyl)benzamide
CID 24666765
4-butyl-N-(3,4-dichlorophenyl)benzamide
CID 3618565
N-(3-acetamido-4-methoxyphenyl)-3-bromobenzamide
CID 35346015
N-(3-acetamido-4-methoxyphenyl)-4-butoxy-3-chloro-5-ethoxybenzamide
CID 33309669
N-(3-acetamido-4-methoxyphenyl)-2,3-dimethylquinoxaline-6-carboxamide
CID 46543736
N-(4-butylphenyl)-2,4,5-trimethoxybenzamide
CID 9442098
N-(4-butylphenyl)-4-methoxy-3-(propan-2-ylsulfamoyl)benzamide
CID 45373539
N-(5-acetamido-2-methoxyphenyl)-4-cyanobenzamide
CID 2450406
N-(4-butylphenyl)-5-chloro-2-methoxybenzamide
CID 3544721
4-ethyl-N-[3-methoxy-4-(pentanoylamino)phenyl]benzamide
CID 2993875

Frequently Asked Questions

What is the IUPAC name of N-(3-acetamido-4-methoxyphenyl)-4-butylbenzamide?
The IUPAC name of N-(3-acetamido-4-methoxyphenyl)-4-butylbenzamide (CID 24666778) is N-(3-acetamido-4-methoxyphenyl)-4-butylbenzamide.
What is the SMILES notation for N-(3-acetamido-4-methoxyphenyl)-4-butylbenzamide?
The canonical SMILES for N-(3-acetamido-4-methoxyphenyl)-4-butylbenzamide is CCCCc1ccc(C(=O)Nc2ccc(OC)c(NC(C)=O)c2)cc1.
What is the InChIKey of N-(3-acetamido-4-methoxyphenyl)-4-butylbenzamide?
The InChIKey is JHRCRUUIIPYAKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O3/c1-4-5-6-15-7-9-16(10-8-15)20(24)22-17-11-12-19(25-3)18(13-17)21-14(2)23/h7-13H,4-6H2,1-3H3,(H,21,23)(H,22,24).
What are the key properties of N-(3-acetamido-4-methoxyphenyl)-4-butylbenzamide?
N-(3-acetamido-4-methoxyphenyl)-4-butylbenzamide has a molecular weight of 340.42 g/mol, XLogP of 4.25, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-acetamido-4-methoxyphenyl)-4-butylbenzamide is sourced from PubChem (CID 24666778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).