N-(3,5-dichlorophenyl)-3-phenoxypropanamide

C15H13Cl2NO2 — CID 26591488

IUPACN-(3,5-dichlorophenyl)-3-phenoxypropanamide
SMILESO=C(CCOc1ccccc1)Nc1cc(Cl)cc(Cl)c1
InChIInChI=1S/C15H13Cl2NO2/c16-11-8-12(17)10-13(9-11)18-15(19)6-7-20-14-4-2-1-3-5-14/h1-5,8-10H,6-7H2,(H,18,19)
InChIKeyGAQGFVCEUAVSQH-UHFFFAOYSA-N
MW310.18 g/mol
LogP4.40
Rot. Bonds5

About N-(3,5-dichlorophenyl)-3-phenoxypropanamide

N-(3,5-dichlorophenyl)-3-phenoxypropanamide (PubChem CID 26591488) has the molecular formula C15H13Cl2NO2 and a molecular weight of 310.18 g/mol. Its IUPAC name is N-(3,5-dichlorophenyl)-3-phenoxypropanamide.

Molecular Properties

Compound NameN-(3,5-dichlorophenyl)-3-phenoxypropanamide
PubChem CID26591488
Molecular FormulaC15H13Cl2NO2
Molecular Weight310.18 g/mol
Exact Mass309.03
IUPAC NameN-(3,5-dichlorophenyl)-3-phenoxypropanamide
SMILESO=C(CCOc1ccccc1)Nc1cc(Cl)cc(Cl)c1
InChIInChI=1S/C15H13Cl2NO2/c16-11-8-12(17)10-13(9-11)18-15(19)6-7-20-14-4-2-1-3-5-14/h1-5,8-10H,6-7H2,(H,18,19)
InChIKeyGAQGFVCEUAVSQH-UHFFFAOYSA-N
XLogP4.40
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.18
LogP ≤ 54.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(3-aminophenoxy)-N-(3,5-dichlorophenyl)propanamide
CID 61090468
N-[(3,5-dichlorophenyl)carbamothioyl]-4-phenoxybutanamide
CID 19188390
N-[3,5-bis(trifluoromethyl)phenyl]-3-phenoxypropanamide
CID 108795497
3-phenoxy-N-(4-phenoxyphenyl)propanamide
CID 108795457
N-[2-(4-chloroanilino)-2-oxoethyl]-3-phenoxypropanamide
CID 112997910
N-[(3,5-dichlorophenyl)carbamothioyl]-2-phenoxyacetamide
CID 1014402
N-(4-tert-butylphenyl)-3-phenoxypropanamide
CID 7658805
N-(3,5-dichlorophenyl)-2-(4-phenylmethoxyphenoxy)acetamide
CID 7926056
2-hydroxy-4-(3-phenoxypropanoylamino)benzoic acid
CID 108806972
N-(3-formylphenyl)-3-phenoxypropanamide
CID 106912466
N-[4-(5-chloro-2-methoxyanilino)phenyl]-3-phenoxypropanamide
CID 112987250
3-(4-tert-butylphenoxy)-N-(3-chlorophenyl)propanamide
CID 2408222

Frequently Asked Questions

What is the IUPAC name of N-(3,5-dichlorophenyl)-3-phenoxypropanamide?
The IUPAC name of N-(3,5-dichlorophenyl)-3-phenoxypropanamide (CID 26591488) is N-(3,5-dichlorophenyl)-3-phenoxypropanamide.
What is the SMILES notation for N-(3,5-dichlorophenyl)-3-phenoxypropanamide?
The canonical SMILES for N-(3,5-dichlorophenyl)-3-phenoxypropanamide is O=C(CCOc1ccccc1)Nc1cc(Cl)cc(Cl)c1.
What is the InChIKey of N-(3,5-dichlorophenyl)-3-phenoxypropanamide?
The InChIKey is GAQGFVCEUAVSQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13Cl2NO2/c16-11-8-12(17)10-13(9-11)18-15(19)6-7-20-14-4-2-1-3-5-14/h1-5,8-10H,6-7H2,(H,18,19).
What are the key properties of N-(3,5-dichlorophenyl)-3-phenoxypropanamide?
N-(3,5-dichlorophenyl)-3-phenoxypropanamide has a molecular weight of 310.18 g/mol, XLogP of 4.40, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dichlorophenyl)-3-phenoxypropanamide is sourced from PubChem (CID 26591488), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).