3-(2,4-dichlorophenyl)-N-naphthalen-2-ylpropanamide

C19H15Cl2NO — CID 100605346

IUPAC3-(2,4-dichlorophenyl)-N-naphthalen-2-ylpropanamide
SMILESO=C(CCc1ccc(Cl)cc1Cl)Nc1ccc2ccccc2c1
InChIInChI=1S/C19H15Cl2NO/c20-16-8-5-14(18(21)12-16)7-10-19(23)22-17-9-6-13-3-1-2-4-15(13)11-17/h1-6,8-9,11-12H,7,10H2,(H,22,23)
InChIKeyFSSAQBUGCFEVOW-UHFFFAOYSA-N
MW344.24 g/mol
LogP5.72
Rot. Bonds4

About 3-(2,4-dichlorophenyl)-N-naphthalen-2-ylpropanamide

3-(2,4-dichlorophenyl)-N-naphthalen-2-ylpropanamide (PubChem CID 100605346) has the molecular formula C19H15Cl2NO and a molecular weight of 344.24 g/mol. Its IUPAC name is 3-(2,4-dichlorophenyl)-N-naphthalen-2-ylpropanamide.

Molecular Properties

Compound Name3-(2,4-dichlorophenyl)-N-naphthalen-2-ylpropanamide
PubChem CID100605346
Molecular FormulaC19H15Cl2NO
Molecular Weight344.24 g/mol
Exact Mass343.05
IUPAC Name3-(2,4-dichlorophenyl)-N-naphthalen-2-ylpropanamide
SMILESO=C(CCc1ccc(Cl)cc1Cl)Nc1ccc2ccccc2c1
InChIInChI=1S/C19H15Cl2NO/c20-16-8-5-14(18(21)12-16)7-10-19(23)22-17-9-6-13-3-1-2-4-15(13)11-17/h1-6,8-9,11-12H,7,10H2,(H,22,23)
InChIKeyFSSAQBUGCFEVOW-UHFFFAOYSA-N
XLogP5.72
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500344.24
LogP ≤ 55.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-(4-bromo-3-chlorophenyl)-3-(2,4-dichlorophenyl)propanamide
CID 100606713
N-(3-acetylphenyl)-3-(2,4-dichlorophenyl)propanamide
CID 100606597
3-(2,4-dichlorophenyl)-N-(3-methylsulfanylphenyl)propanamide
CID 100606198
3-(2,4-dichlorophenyl)-N-[3-[(2-methoxyacetyl)amino]phenyl]propanamide
CID 55567336
3-(2,4-dichlorophenyl)-N-[3-(trifluoromethyl)phenyl]propanamide
CID 100605483
4-[3-(2,4-dichlorophenyl)propanoylamino]-N,N-dimethylbenzamide
CID 92851593
3-(2,4-dichlorophenyl)-N-(2-methylsulfanylphenyl)propanamide
CID 100606765
3-(4-chlorophenyl)sulfonyl-N-naphthalen-2-ylpropanamide
CID 2902895
[3-(naphthalen-2-ylamino)-3-oxopropyl]azanium
CID 7021427
3-(2,4-dichlorophenyl)-N-methylpropanamide
CID 60731277
2-(3,4-dichlorophenyl)-N-naphthalen-2-ylacetamide
CID 7900527
1-[(2,4-dichlorophenyl)methyl]-N-naphthalen-2-ylpiperidine-4-carboxamide
CID 43919622

Frequently Asked Questions

What is the IUPAC name of 3-(2,4-dichlorophenyl)-N-naphthalen-2-ylpropanamide?
The IUPAC name of 3-(2,4-dichlorophenyl)-N-naphthalen-2-ylpropanamide (CID 100605346) is 3-(2,4-dichlorophenyl)-N-naphthalen-2-ylpropanamide.
What is the SMILES notation for 3-(2,4-dichlorophenyl)-N-naphthalen-2-ylpropanamide?
The canonical SMILES for 3-(2,4-dichlorophenyl)-N-naphthalen-2-ylpropanamide is O=C(CCc1ccc(Cl)cc1Cl)Nc1ccc2ccccc2c1.
What is the InChIKey of 3-(2,4-dichlorophenyl)-N-naphthalen-2-ylpropanamide?
The InChIKey is FSSAQBUGCFEVOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15Cl2NO/c20-16-8-5-14(18(21)12-16)7-10-19(23)22-17-9-6-13-3-1-2-4-15(13)11-17/h1-6,8-9,11-12H,7,10H2,(H,22,23).
What are the key properties of 3-(2,4-dichlorophenyl)-N-naphthalen-2-ylpropanamide?
3-(2,4-dichlorophenyl)-N-naphthalen-2-ylpropanamide has a molecular weight of 344.24 g/mol, XLogP of 5.72, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,4-dichlorophenyl)-N-naphthalen-2-ylpropanamide is sourced from PubChem (CID 100605346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).