3-(2,3-dichlorophenyl)-N-phenylpropanamide

C15H13Cl2NO — CID 38885504

IUPAC3-(2,3-dichlorophenyl)-N-phenylpropanamide
SMILESO=C(CCc1cccc(Cl)c1Cl)Nc1ccccc1
InChIInChI=1S/C15H13Cl2NO/c16-13-8-4-5-11(15(13)17)9-10-14(19)18-12-6-2-1-3-7-12/h1-8H,9-10H2,(H,18,19)
InChIKeyXKGRSOIMBPIHFI-UHFFFAOYSA-N
MW294.18 g/mol
LogP4.56
Rot. Bonds4

About 3-(2,3-dichlorophenyl)-N-phenylpropanamide

3-(2,3-dichlorophenyl)-N-phenylpropanamide (PubChem CID 38885504) has the molecular formula C15H13Cl2NO and a molecular weight of 294.18 g/mol. Its IUPAC name is 3-(2,3-dichlorophenyl)-N-phenylpropanamide.

Molecular Properties

Compound Name3-(2,3-dichlorophenyl)-N-phenylpropanamide
PubChem CID38885504
Molecular FormulaC15H13Cl2NO
Molecular Weight294.18 g/mol
Exact Mass293.04
IUPAC Name3-(2,3-dichlorophenyl)-N-phenylpropanamide
SMILESO=C(CCc1cccc(Cl)c1Cl)Nc1ccccc1
InChIInChI=1S/C15H13Cl2NO/c16-13-8-4-5-11(15(13)17)9-10-14(19)18-12-6-2-1-3-7-12/h1-8H,9-10H2,(H,18,19)
InChIKeyXKGRSOIMBPIHFI-UHFFFAOYSA-N
XLogP4.56
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.18
LogP ≤ 54.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3-(2,3-dichlorophenyl)-N-(2-ethylphenyl)propanamide
CID 38910581
3-(2,3-dichlorophenyl)-N-(3-nitrophenyl)propanamide
CID 38925954
3-(2,3-dichlorophenyl)-N-(2-iodophenyl)propanamide
CID 38886351
N-tert-butyl-4-[3-(2,3-dichlorophenyl)propanoylamino]benzamide
CID 38950553
3-(2,3-dichlorophenyl)-N-[3-(1,3-dioxoisoindol-2-yl)phenyl]propanamide
CID 56507680
N-[3-(2-amino-2-oxoethoxy)phenyl]-3-(2,3-dichlorophenyl)propanamide
CID 38939684
N-(3-bromophenyl)-3-(2-chlorophenyl)propanamide
CID 17252222
3-(2-chlorophenyl)-N-(2,6-dichlorophenyl)propanamide
CID 51058277
3-(2,3-dichlorophenyl)-N-[4-(2-oxopyrrolidin-1-yl)phenyl]propanamide
CID 38924388
3-(2,3-dichlorophenyl)-N-[(1-phenylcyclopropyl)methyl]propanamide
CID 38937319
ethyl 2-[3-[3-(2,3-dichlorophenyl)propanoylamino]phenoxy]acetate
CID 55706670
3-(2-chlorophenyl)-N-[4-[(2,2,2-trifluoroacetyl)amino]phenyl]propanamide
CID 110622808

Frequently Asked Questions

What is the IUPAC name of 3-(2,3-dichlorophenyl)-N-phenylpropanamide?
The IUPAC name of 3-(2,3-dichlorophenyl)-N-phenylpropanamide (CID 38885504) is 3-(2,3-dichlorophenyl)-N-phenylpropanamide.
What is the SMILES notation for 3-(2,3-dichlorophenyl)-N-phenylpropanamide?
The canonical SMILES for 3-(2,3-dichlorophenyl)-N-phenylpropanamide is O=C(CCc1cccc(Cl)c1Cl)Nc1ccccc1.
What is the InChIKey of 3-(2,3-dichlorophenyl)-N-phenylpropanamide?
The InChIKey is XKGRSOIMBPIHFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13Cl2NO/c16-13-8-4-5-11(15(13)17)9-10-14(19)18-12-6-2-1-3-7-12/h1-8H,9-10H2,(H,18,19).
What are the key properties of 3-(2,3-dichlorophenyl)-N-phenylpropanamide?
3-(2,3-dichlorophenyl)-N-phenylpropanamide has a molecular weight of 294.18 g/mol, XLogP of 4.56, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,3-dichlorophenyl)-N-phenylpropanamide is sourced from PubChem (CID 38885504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).