N-(4-methoxyphenyl)-4-(4-oxopentanoylamino)benzamide

C19H20N2O4 — CID 9415671

IUPACN-(4-methoxyphenyl)-4-(4-oxopentanoylamino)benzamide
SMILESCOc1ccc(NC(=O)c2ccc(NC(=O)CCC(C)=O)cc2)cc1
InChIInChI=1S/C19H20N2O4/c1-13(22)3-12-18(23)20-15-6-4-14(5-7-15)19(24)21-16-8-10-17(25-2)11-9-16/h4-11H,3,12H2,1-2H3,(H,20,23)(H,21,24)
InChIKeyAYPAUEQNNUNHQX-UHFFFAOYSA-N
MW340.38 g/mol
LogP3.26
Rot. Bonds7

About N-(4-methoxyphenyl)-4-(4-oxopentanoylamino)benzamide

N-(4-methoxyphenyl)-4-(4-oxopentanoylamino)benzamide (PubChem CID 9415671) has the molecular formula C19H20N2O4 and a molecular weight of 340.38 g/mol. Its IUPAC name is N-(4-methoxyphenyl)-4-(4-oxopentanoylamino)benzamide.

Molecular Properties

Compound NameN-(4-methoxyphenyl)-4-(4-oxopentanoylamino)benzamide
PubChem CID9415671
Molecular FormulaC19H20N2O4
Molecular Weight340.38 g/mol
Exact Mass340.14
IUPAC NameN-(4-methoxyphenyl)-4-(4-oxopentanoylamino)benzamide
SMILESCOc1ccc(NC(=O)c2ccc(NC(=O)CCC(C)=O)cc2)cc1
InChIInChI=1S/C19H20N2O4/c1-13(22)3-12-18(23)20-15-6-4-14(5-7-15)19(24)21-16-8-10-17(25-2)11-9-16/h4-11H,3,12H2,1-2H3,(H,20,23)(H,21,24)
InChIKeyAYPAUEQNNUNHQX-UHFFFAOYSA-N
XLogP3.26
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.38
LogP ≤ 53.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-methoxyphenyl)-4-(3-oxobutanoylamino)benzamide
CID 110178700
4-[[2-(4-methoxyphenoxy)acetyl]amino]-N-(4-methoxyphenyl)benzamide
CID 2710766
N-ethyl-4-[(4-methoxybenzoyl)amino]benzamide
CID 17234279
4-(3-benzamidopropanoylamino)-N-(4-methoxyphenyl)benzamide
CID 8884300
N-(4-methoxyphenyl)-4-(3-methylbutanoylamino)benzamide
CID 2994922
N-(4-methoxyphenyl)-4-[(2-methylsulfanylacetyl)amino]benzamide
CID 8884327
N-[4-(4-acetamidoanilino)phenyl]-4-methoxybenzamide
CID 112988363
methyl 4-[(4-methoxyphenyl)carbamoyl]benzoate
CID 7733773
N-(4-methoxyphenyl)-4-(3-phenylsulfanylpropanoylamino)benzamide
CID 9415706
4-(4-methoxyanilino)-4-oxobutanoyl chloride
CID 82041607
N-(4-bromophenyl)-4-[(4-methoxybenzoyl)amino]benzamide
CID 2214535
4-hydrazinyl-N-(4-methoxyphenyl)benzamide
CID 62237684

Frequently Asked Questions

What is the IUPAC name of N-(4-methoxyphenyl)-4-(4-oxopentanoylamino)benzamide?
The IUPAC name of N-(4-methoxyphenyl)-4-(4-oxopentanoylamino)benzamide (CID 9415671) is N-(4-methoxyphenyl)-4-(4-oxopentanoylamino)benzamide.
What is the SMILES notation for N-(4-methoxyphenyl)-4-(4-oxopentanoylamino)benzamide?
The canonical SMILES for N-(4-methoxyphenyl)-4-(4-oxopentanoylamino)benzamide is COc1ccc(NC(=O)c2ccc(NC(=O)CCC(C)=O)cc2)cc1.
What is the InChIKey of N-(4-methoxyphenyl)-4-(4-oxopentanoylamino)benzamide?
The InChIKey is AYPAUEQNNUNHQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O4/c1-13(22)3-12-18(23)20-15-6-4-14(5-7-15)19(24)21-16-8-10-17(25-2)11-9-16/h4-11H,3,12H2,1-2H3,(H,20,23)(H,21,24).
What are the key properties of N-(4-methoxyphenyl)-4-(4-oxopentanoylamino)benzamide?
N-(4-methoxyphenyl)-4-(4-oxopentanoylamino)benzamide has a molecular weight of 340.38 g/mol, XLogP of 3.26, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxyphenyl)-4-(4-oxopentanoylamino)benzamide is sourced from PubChem (CID 9415671), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).