2-(2,4-dichlorophenoxy)-N-(phenylcarbamoyl)propanamide

C16H14Cl2N2O3 — CID 24569411

IUPAC2-(2,4-dichlorophenoxy)-N-(phenylcarbamoyl)propanamide
SMILESCC(Oc1ccc(Cl)cc1Cl)C(=O)NC(=O)Nc1ccccc1
InChIInChI=1S/C16H14Cl2N2O3/c1-10(23-14-8-7-11(17)9-13(14)18)15(21)20-16(22)19-12-5-3-2-4-6-12/h2-10H,1H3,(H2,19,20,21,22)
InChIKeyTWFQHSQLWKFGSA-UHFFFAOYSA-N
MW353.21 g/mol
LogP4.11
Rot. Bonds4

About 2-(2,4-dichlorophenoxy)-N-(phenylcarbamoyl)propanamide

2-(2,4-dichlorophenoxy)-N-(phenylcarbamoyl)propanamide (PubChem CID 24569411) has the molecular formula C16H14Cl2N2O3 and a molecular weight of 353.21 g/mol. Its IUPAC name is 2-(2,4-dichlorophenoxy)-N-(phenylcarbamoyl)propanamide.

Molecular Properties

Compound Name2-(2,4-dichlorophenoxy)-N-(phenylcarbamoyl)propanamide
PubChem CID24569411
Molecular FormulaC16H14Cl2N2O3
Molecular Weight353.21 g/mol
Exact Mass352.04
IUPAC Name2-(2,4-dichlorophenoxy)-N-(phenylcarbamoyl)propanamide
SMILESCC(Oc1ccc(Cl)cc1Cl)C(=O)NC(=O)Nc1ccccc1
InChIInChI=1S/C16H14Cl2N2O3/c1-10(23-14-8-7-11(17)9-13(14)18)15(21)20-16(22)19-12-5-3-2-4-6-12/h2-10H,1H3,(H2,19,20,21,22)
InChIKeyTWFQHSQLWKFGSA-UHFFFAOYSA-N
XLogP4.11
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.21
LogP ≤ 54.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[2-[2-(2,4-dichlorophenoxy)propanoyl]hydrazinyl]-2-oxo-N-phenylacetamide
CID 17078734
N-[4-[[(2S)-2-(2,4-dichlorophenoxy)propanoyl]amino]phenyl]-2-methylpropanamide
CID 1293450
(2R)-N-(4-acetamidophenyl)-2-(2,4-dichlorophenoxy)propanamide
CID 1010932
(2R)-2-(2,4-dichlorophenoxy)-N-(4-propan-2-ylphenyl)propanamide
CID 1335441
(2R)-2-(4-chloro-2-methylphenoxy)-N-phenylpropanamide
CID 723976
N-[4-[[[(2R)-2-(2,4-dichlorophenoxy)propanoyl]amino]carbamoyl]phenyl]benzamide
CID 2210922
(2R)-2-(2,4-dichlorophenoxy)-N-(3-methylphenyl)propanamide
CID 2164297
N-(4-bromophenyl)-2-(2,4-dichlorophenoxy)propanamide
CID 2725599
2-(2,4-dichlorophenoxy)-N-[4-(difluoromethoxy)phenyl]propanamide
CID 42989366
(2R)-2-(2,4-dichlorophenoxy)-N-naphthalen-2-ylpropanamide
CID 7723467
(2R)-2-(2,4-dichlorophenoxy)-N-(2-ethylphenyl)propanamide
CID 785428
(2R)-2-(2,4-dichlorophenoxy)-N-(2-fluorophenyl)propanamide
CID 881150

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dichlorophenoxy)-N-(phenylcarbamoyl)propanamide?
The IUPAC name of 2-(2,4-dichlorophenoxy)-N-(phenylcarbamoyl)propanamide (CID 24569411) is 2-(2,4-dichlorophenoxy)-N-(phenylcarbamoyl)propanamide.
What is the SMILES notation for 2-(2,4-dichlorophenoxy)-N-(phenylcarbamoyl)propanamide?
The canonical SMILES for 2-(2,4-dichlorophenoxy)-N-(phenylcarbamoyl)propanamide is CC(Oc1ccc(Cl)cc1Cl)C(=O)NC(=O)Nc1ccccc1.
What is the InChIKey of 2-(2,4-dichlorophenoxy)-N-(phenylcarbamoyl)propanamide?
The InChIKey is TWFQHSQLWKFGSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14Cl2N2O3/c1-10(23-14-8-7-11(17)9-13(14)18)15(21)20-16(22)19-12-5-3-2-4-6-12/h2-10H,1H3,(H2,19,20,21,22).
What are the key properties of 2-(2,4-dichlorophenoxy)-N-(phenylcarbamoyl)propanamide?
2-(2,4-dichlorophenoxy)-N-(phenylcarbamoyl)propanamide has a molecular weight of 353.21 g/mol, XLogP of 4.11, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dichlorophenoxy)-N-(phenylcarbamoyl)propanamide is sourced from PubChem (CID 24569411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).