N-[1-(3-acetamidophenyl)ethyl]-2-(4-chlorophenyl)acetamide

C18H19ClN2O2 — CID 46598816

IUPACN-[1-(3-acetamidophenyl)ethyl]-2-(4-chlorophenyl)acetamide
SMILESCC(=O)Nc1cccc(C(C)NC(=O)Cc2ccc(Cl)cc2)c1
InChIInChI=1S/C18H19ClN2O2/c1-12(15-4-3-5-17(11-15)21-13(2)22)20-18(23)10-14-6-8-16(19)9-7-14/h3-9,11-12H,10H2,1-2H3,(H,20,23)(H,21,22)
InChIKeyCLJOVROEKKTPLK-UHFFFAOYSA-N
MW330.82 g/mol
LogP3.72
Rot. Bonds5

About N-[1-(3-acetamidophenyl)ethyl]-2-(4-chlorophenyl)acetamide

N-[1-(3-acetamidophenyl)ethyl]-2-(4-chlorophenyl)acetamide (PubChem CID 46598816) has the molecular formula C18H19ClN2O2 and a molecular weight of 330.82 g/mol. Its IUPAC name is N-[1-(3-acetamidophenyl)ethyl]-2-(4-chlorophenyl)acetamide.

Molecular Properties

Compound NameN-[1-(3-acetamidophenyl)ethyl]-2-(4-chlorophenyl)acetamide
PubChem CID46598816
Molecular FormulaC18H19ClN2O2
Molecular Weight330.82 g/mol
Exact Mass330.11
IUPAC NameN-[1-(3-acetamidophenyl)ethyl]-2-(4-chlorophenyl)acetamide
SMILESCC(=O)Nc1cccc(C(C)NC(=O)Cc2ccc(Cl)cc2)c1
InChIInChI=1S/C18H19ClN2O2/c1-12(15-4-3-5-17(11-15)21-13(2)22)20-18(23)10-14-6-8-16(19)9-7-14/h3-9,11-12H,10H2,1-2H3,(H,20,23)(H,21,22)
InChIKeyCLJOVROEKKTPLK-UHFFFAOYSA-N
XLogP3.72
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.82
LogP ≤ 53.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[1-(3-acetamidophenyl)ethyl]-3-oxobutanamide
CID 54880254
2-(4-chlorophenyl)-N-[(1R)-1-(4-chlorophenyl)ethyl]acetamide
CID 8751569
N-[1-(3-acetamidophenyl)ethyl]-3-aminobutanamide
CID 54880253
3-[[2-(4-chlorophenyl)acetyl]amino]-N-(1-phenylethyl)benzamide
CID 43877795
N-[3-[1-[1-(4-chlorophenyl)propylamino]ethyl]phenyl]acetamide
CID 119139033
N-[1-(3-acetamidophenyl)ethyl]-2-(2-methoxyphenyl)acetamide
CID 46580356
2-(4-bromophenyl)-N-[(1S)-1-(3-chlorophenyl)ethyl]acetamide
CID 9164817
N-[2-[1-(3-acetamidophenyl)ethylamino]-2-oxoethyl]-2,2-dimethylpropanamide
CID 46580612
N-[1-(3-acetamidophenyl)ethyl]-5-amino-4-methylpentanamide
CID 82014074
[2-[[(1S)-1-(3-chlorophenyl)ethyl]amino]-2-oxoethyl] 2-(4-chlorophenyl)acetate
CID 8579291
N-[3-[1-[[2-(4-chlorophenoxy)acetyl]amino]ethyl]phenyl]benzamide
CID 46456558
2-(4-chlorophenyl)-N-[(1R)-1-(4-ethylphenyl)ethyl]acetamide
CID 93236026

Frequently Asked Questions

What is the IUPAC name of N-[1-(3-acetamidophenyl)ethyl]-2-(4-chlorophenyl)acetamide?
The IUPAC name of N-[1-(3-acetamidophenyl)ethyl]-2-(4-chlorophenyl)acetamide (CID 46598816) is N-[1-(3-acetamidophenyl)ethyl]-2-(4-chlorophenyl)acetamide.
What is the SMILES notation for N-[1-(3-acetamidophenyl)ethyl]-2-(4-chlorophenyl)acetamide?
The canonical SMILES for N-[1-(3-acetamidophenyl)ethyl]-2-(4-chlorophenyl)acetamide is CC(=O)Nc1cccc(C(C)NC(=O)Cc2ccc(Cl)cc2)c1.
What is the InChIKey of N-[1-(3-acetamidophenyl)ethyl]-2-(4-chlorophenyl)acetamide?
The InChIKey is CLJOVROEKKTPLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19ClN2O2/c1-12(15-4-3-5-17(11-15)21-13(2)22)20-18(23)10-14-6-8-16(19)9-7-14/h3-9,11-12H,10H2,1-2H3,(H,20,23)(H,21,22).
What are the key properties of N-[1-(3-acetamidophenyl)ethyl]-2-(4-chlorophenyl)acetamide?
N-[1-(3-acetamidophenyl)ethyl]-2-(4-chlorophenyl)acetamide has a molecular weight of 330.82 g/mol, XLogP of 3.72, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(3-acetamidophenyl)ethyl]-2-(4-chlorophenyl)acetamide is sourced from PubChem (CID 46598816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).