3-(2,6-diethylanilino)-N-(2,6-difluorophenyl)propanamide

C19H22F2N2O — CID 109037146

IUPAC3-(2,6-diethylanilino)-N-(2,6-difluorophenyl)propanamide
SMILESCCc1cccc(CC)c1NCCC(=O)Nc1c(F)cccc1F
InChIInChI=1S/C19H22F2N2O/c1-3-13-7-5-8-14(4-2)18(13)22-12-11-17(24)23-19-15(20)9-6-10-16(19)21/h5-10,22H,3-4,11-12H2,1-2H3,(H,23,24)
InChIKeyMJLWIHJMYQVIFC-UHFFFAOYSA-N
MW332.39 g/mol
LogP4.53
Rot. Bonds7

About 3-(2,6-diethylanilino)-N-(2,6-difluorophenyl)propanamide

3-(2,6-diethylanilino)-N-(2,6-difluorophenyl)propanamide (PubChem CID 109037146) has the molecular formula C19H22F2N2O and a molecular weight of 332.39 g/mol. Its IUPAC name is 3-(2,6-diethylanilino)-N-(2,6-difluorophenyl)propanamide.

Molecular Properties

Compound Name3-(2,6-diethylanilino)-N-(2,6-difluorophenyl)propanamide
PubChem CID109037146
Molecular FormulaC19H22F2N2O
Molecular Weight332.39 g/mol
Exact Mass332.17
IUPAC Name3-(2,6-diethylanilino)-N-(2,6-difluorophenyl)propanamide
SMILESCCc1cccc(CC)c1NCCC(=O)Nc1c(F)cccc1F
InChIInChI=1S/C19H22F2N2O/c1-3-13-7-5-8-14(4-2)18(13)22-12-11-17(24)23-19-15(20)9-6-10-16(19)21/h5-10,22H,3-4,11-12H2,1-2H3,(H,23,24)
InChIKeyMJLWIHJMYQVIFC-UHFFFAOYSA-N
XLogP4.53
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.39
LogP ≤ 54.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 3-(2,6-diethylanilino)-N-(2,6-difluorophenyl)propanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-(2,6-dichloroanilino)-N-(2,6-difluorophenyl)propanamide
CID 109042717
N-(2,6-diethylphenyl)-2-(2,6-difluoroanilino)acetamide
CID 109008077
3-(2,6-diethylanilino)-N-(4-methylphenyl)propanamide
CID 109034349
3-(3-acetamidoanilino)-N-(2,6-difluorophenyl)propanamide
CID 109041187
3-(2,6-difluoroanilino)-N-(2-ethoxyphenyl)propanamide
CID 109039796
N-(2,6-difluorophenyl)-3-[(5-methyl-1,2-oxazol-3-yl)amino]propanamide
CID 109042862
3-(2,6-diethylanilino)-N-(2-methoxyphenyl)propanamide
CID 109037115
3-(5-chloro-2-methylanilino)-N-(2,6-difluorophenyl)propanamide
CID 109038491
3-(2,6-diethylanilino)-N-[2-(4-fluorophenyl)ethyl]propanamide
CID 109024995
3-(3-chloro-4-fluoroanilino)-N-(2,6-difluorophenyl)propanamide
CID 109038862
methyl 3-(2,6-difluoroanilino)propanoate
CID 43365450
N-(3-chloro-4-methylphenyl)-3-(2,6-difluoroanilino)propanamide
CID 109038664

Frequently Asked Questions

What is the IUPAC name of 3-(2,6-diethylanilino)-N-(2,6-difluorophenyl)propanamide?
The IUPAC name of 3-(2,6-diethylanilino)-N-(2,6-difluorophenyl)propanamide (CID 109037146) is 3-(2,6-diethylanilino)-N-(2,6-difluorophenyl)propanamide.
What is the SMILES notation for 3-(2,6-diethylanilino)-N-(2,6-difluorophenyl)propanamide?
The canonical SMILES for 3-(2,6-diethylanilino)-N-(2,6-difluorophenyl)propanamide is CCc1cccc(CC)c1NCCC(=O)Nc1c(F)cccc1F.
What is the InChIKey of 3-(2,6-diethylanilino)-N-(2,6-difluorophenyl)propanamide?
The InChIKey is MJLWIHJMYQVIFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22F2N2O/c1-3-13-7-5-8-14(4-2)18(13)22-12-11-17(24)23-19-15(20)9-6-10-16(19)21/h5-10,22H,3-4,11-12H2,1-2H3,(H,23,24).
What are the key properties of 3-(2,6-diethylanilino)-N-(2,6-difluorophenyl)propanamide?
3-(2,6-diethylanilino)-N-(2,6-difluorophenyl)propanamide has a molecular weight of 332.39 g/mol, XLogP of 4.53, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,6-diethylanilino)-N-(2,6-difluorophenyl)propanamide is sourced from PubChem (CID 109037146), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).