2-(1-anilino-1-oxopropan-2-yl)oxy-N-phenylpropanamide

C18H20N2O3 — CID 141218606

IUPAC2-(1-anilino-1-oxopropan-2-yl)oxy-N-phenylpropanamide
SMILESCC(OC(C)C(=O)Nc1ccccc1)C(=O)Nc1ccccc1
InChIInChI=1S/C18H20N2O3/c1-13(17(21)19-15-9-5-3-6-10-15)23-14(2)18(22)20-16-11-7-4-8-12-16/h3-14H,1-2H3,(H,19,21)(H,20,22)
InChIKeyWLLSRLNTXWIZHP-UHFFFAOYSA-N
MW312.37 g/mol
LogP3.06
Rot. Bonds6

About 2-(1-anilino-1-oxopropan-2-yl)oxy-N-phenylpropanamide

2-(1-anilino-1-oxopropan-2-yl)oxy-N-phenylpropanamide (PubChem CID 141218606) has the molecular formula C18H20N2O3 and a molecular weight of 312.37 g/mol. Its IUPAC name is 2-(1-anilino-1-oxopropan-2-yl)oxy-N-phenylpropanamide.

Molecular Properties

Compound Name2-(1-anilino-1-oxopropan-2-yl)oxy-N-phenylpropanamide
PubChem CID141218606
Molecular FormulaC18H20N2O3
Molecular Weight312.37 g/mol
Exact Mass312.15
IUPAC Name2-(1-anilino-1-oxopropan-2-yl)oxy-N-phenylpropanamide
SMILESCC(OC(C)C(=O)Nc1ccccc1)C(=O)Nc1ccccc1
InChIInChI=1S/C18H20N2O3/c1-13(17(21)19-15-9-5-3-6-10-15)23-14(2)18(22)20-16-11-7-4-8-12-16/h3-14H,1-2H3,(H,19,21)(H,20,22)
InChIKeyWLLSRLNTXWIZHP-UHFFFAOYSA-N
XLogP3.06
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 ≤ 53.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-2-methoxy-N-phenylpropanamide
CID 11805321
[(2S)-1-anilino-1-oxopropan-2-yl] acetate
CID 7000051
2-(2-amino-2-methylpropoxy)-N-phenylpropanamide
CID 64536975
N-phenyl-2-(4-phenylphenoxy)propanamide
CID 2969640
(2R)-2-amino-N-phenylpropanamide
CID 10607114
N-(4-acetamidophenyl)-2-phenoxypropanamide
CID 2897872
(2S)-2-(2-bromophenoxy)-N-phenylpropanamide
CID 7394881
4-O-[(2S)-1-anilino-1-oxopropan-2-yl] 1-O-methyl benzene-1,4-dicarboxylate
CID 7296552
2-(4-chlorophenoxy)-N-phenylpropanamide
CID 4943865
2-(4-aminophenoxy)-N-phenylpropanamide
CID 43115954
[(2R)-1-anilino-1-oxopropan-2-yl] cyclopropanecarboxylate
CID 2511050
[(2S)-1-anilino-1-oxopropan-2-yl] 4-methylbenzoate
CID 2506398

Frequently Asked Questions

What is the IUPAC name of 2-(1-anilino-1-oxopropan-2-yl)oxy-N-phenylpropanamide?
The IUPAC name of 2-(1-anilino-1-oxopropan-2-yl)oxy-N-phenylpropanamide (CID 141218606) is 2-(1-anilino-1-oxopropan-2-yl)oxy-N-phenylpropanamide.
What is the SMILES notation for 2-(1-anilino-1-oxopropan-2-yl)oxy-N-phenylpropanamide?
The canonical SMILES for 2-(1-anilino-1-oxopropan-2-yl)oxy-N-phenylpropanamide is CC(OC(C)C(=O)Nc1ccccc1)C(=O)Nc1ccccc1.
What is the InChIKey of 2-(1-anilino-1-oxopropan-2-yl)oxy-N-phenylpropanamide?
The InChIKey is WLLSRLNTXWIZHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O3/c1-13(17(21)19-15-9-5-3-6-10-15)23-14(2)18(22)20-16-11-7-4-8-12-16/h3-14H,1-2H3,(H,19,21)(H,20,22).
What are the key properties of 2-(1-anilino-1-oxopropan-2-yl)oxy-N-phenylpropanamide?
2-(1-anilino-1-oxopropan-2-yl)oxy-N-phenylpropanamide has a molecular weight of 312.37 g/mol, XLogP of 3.06, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-anilino-1-oxopropan-2-yl)oxy-N-phenylpropanamide is sourced from PubChem (CID 141218606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).