N-(3-acetamidophenyl)-3-(4-methoxyphenyl)propanamide

C18H20N2O3 — CID 2671013

IUPACN-(3-acetamidophenyl)-3-(4-methoxyphenyl)propanamide
SMILESCOc1ccc(CCC(=O)Nc2cccc(NC(C)=O)c2)cc1
InChIInChI=1S/C18H20N2O3/c1-13(21)19-15-4-3-5-16(12-15)20-18(22)11-8-14-6-9-17(23-2)10-7-14/h3-7,9-10,12H,8,11H2,1-2H3,(H,19,21)(H,20,22)
InChIKeyJFVHFSCBTWJSLC-UHFFFAOYSA-N
MW312.37 g/mol
LogP3.22
Rot. Bonds6

About N-(3-acetamidophenyl)-3-(4-methoxyphenyl)propanamide

N-(3-acetamidophenyl)-3-(4-methoxyphenyl)propanamide (PubChem CID 2671013) has the molecular formula C18H20N2O3 and a molecular weight of 312.37 g/mol. Its IUPAC name is N-(3-acetamidophenyl)-3-(4-methoxyphenyl)propanamide.

Molecular Properties

Compound NameN-(3-acetamidophenyl)-3-(4-methoxyphenyl)propanamide
PubChem CID2671013
Molecular FormulaC18H20N2O3
Molecular Weight312.37 g/mol
Exact Mass312.15
IUPAC NameN-(3-acetamidophenyl)-3-(4-methoxyphenyl)propanamide
SMILESCOc1ccc(CCC(=O)Nc2cccc(NC(C)=O)c2)cc1
InChIInChI=1S/C18H20N2O3/c1-13(21)19-15-4-3-5-16(12-15)20-18(22)11-8-14-6-9-17(23-2)10-7-14/h3-7,9-10,12H,8,11H2,1-2H3,(H,19,21)(H,20,22)
InChIKeyJFVHFSCBTWJSLC-UHFFFAOYSA-N
XLogP3.22
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.37
LogP ≤ 53.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[3-[[2-(4-methoxyphenyl)acetyl]amino]phenyl]-3-phenylpropanamide
CID 17222836
N-(3-iodophenyl)-3-(4-methoxyphenyl)propanamide
CID 7688847
3-(4-methoxyphenyl)-N-[3-(methylaminomethyl)phenyl]propanamide
CID 119441047
3-[3-(4-methoxyphenyl)propanoylamino]-N-methylbenzamide
CID 17439563
4-tert-butyl-N-[3-[3-(4-methoxyphenyl)propanoylamino]phenyl]benzamide
CID 100591859
[3-[[3-[3-(4-methoxyphenyl)propanoylamino]phenyl]carbamoyl]phenyl] acetate
CID 108927930
N,N-diethyl-3-[3-(4-methoxyphenyl)propanoylamino]benzamide
CID 31287562
N-(3-hydroxyphenyl)-4-(4-methoxyphenyl)butanamide
CID 122135780
N-(3-methoxyphenyl)-3-pyridin-4-ylpropanamide
CID 110468427
N-(3-bromophenyl)-4-(4-methoxyphenyl)butanamide
CID 838500
N-(3-acetamidophenyl)-2-(4-methoxyanilino)acetamide
CID 39453688
3-(4-methoxyphenyl)-N-(3,4,5-trimethoxyphenyl)propanamide
CID 7741638

Frequently Asked Questions

What is the IUPAC name of N-(3-acetamidophenyl)-3-(4-methoxyphenyl)propanamide?
The IUPAC name of N-(3-acetamidophenyl)-3-(4-methoxyphenyl)propanamide (CID 2671013) is N-(3-acetamidophenyl)-3-(4-methoxyphenyl)propanamide.
What is the SMILES notation for N-(3-acetamidophenyl)-3-(4-methoxyphenyl)propanamide?
The canonical SMILES for N-(3-acetamidophenyl)-3-(4-methoxyphenyl)propanamide is COc1ccc(CCC(=O)Nc2cccc(NC(C)=O)c2)cc1.
What is the InChIKey of N-(3-acetamidophenyl)-3-(4-methoxyphenyl)propanamide?
The InChIKey is JFVHFSCBTWJSLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O3/c1-13(21)19-15-4-3-5-16(12-15)20-18(22)11-8-14-6-9-17(23-2)10-7-14/h3-7,9-10,12H,8,11H2,1-2H3,(H,19,21)(H,20,22).
What are the key properties of N-(3-acetamidophenyl)-3-(4-methoxyphenyl)propanamide?
N-(3-acetamidophenyl)-3-(4-methoxyphenyl)propanamide has a molecular weight of 312.37 g/mol, XLogP of 3.22, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-acetamidophenyl)-3-(4-methoxyphenyl)propanamide is sourced from PubChem (CID 2671013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).