N-(3,4-difluorophenyl)-2-[(2,4-dimethylphenyl)methyl-methylamino]propanamide

C19H22F2N2O — CID 46563659

IUPACN-(3,4-difluorophenyl)-2-[(2,4-dimethylphenyl)methyl-methylamino]propanamide
SMILESCc1ccc(CN(C)C(C)C(=O)Nc2ccc(F)c(F)c2)c(C)c1
InChIInChI=1S/C19H22F2N2O/c1-12-5-6-15(13(2)9-12)11-23(4)14(3)19(24)22-16-7-8-17(20)18(21)10-16/h5-10,14H,11H2,1-4H3,(H,22,24)
InChIKeyOSLZFCOTGYCLDO-UHFFFAOYSA-N
MW332.39 g/mol
LogP4.04
Rot. Bonds5

About N-(3,4-difluorophenyl)-2-[(2,4-dimethylphenyl)methyl-methylamino]propanamide

N-(3,4-difluorophenyl)-2-[(2,4-dimethylphenyl)methyl-methylamino]propanamide (PubChem CID 46563659) has the molecular formula C19H22F2N2O and a molecular weight of 332.39 g/mol. Its IUPAC name is N-(3,4-difluorophenyl)-2-[(2,4-dimethylphenyl)methyl-methylamino]propanamide.

Molecular Properties

Compound NameN-(3,4-difluorophenyl)-2-[(2,4-dimethylphenyl)methyl-methylamino]propanamide
PubChem CID46563659
Molecular FormulaC19H22F2N2O
Molecular Weight332.39 g/mol
Exact Mass332.17
IUPAC NameN-(3,4-difluorophenyl)-2-[(2,4-dimethylphenyl)methyl-methylamino]propanamide
SMILESCc1ccc(CN(C)C(C)C(=O)Nc2ccc(F)c(F)c2)c(C)c1
InChIInChI=1S/C19H22F2N2O/c1-12-5-6-15(13(2)9-12)11-23(4)14(3)19(24)22-16-7-8-17(20)18(21)10-16/h5-10,14H,11H2,1-4H3,(H,22,24)
InChIKeyOSLZFCOTGYCLDO-UHFFFAOYSA-N
XLogP4.04
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.39
LogP ≤ 54.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-N-(3-acetylphenyl)-2-[(2,4-dimethylphenyl)methyl-methylamino]propanamide
CID 9045544
2-[(2,4-difluorophenyl)methyl-methylamino]-N-(3-fluoro-4-methylphenyl)propanamide
CID 24664447
(2R)-2-[benzyl(methyl)amino]-N-(3,4-difluorophenyl)propanamide
CID 9274686
N-(3,4-difluorophenyl)-2-[[2-[(2,4-dimethylphenyl)methyl-methylamino]acetyl]amino]acetamide
CID 8695732
(2R)-2-[(2,4-dimethylphenyl)methyl-methylamino]-N-(2-methoxyphenyl)propanamide
CID 9045840
(2S)-2-[(2,4-dimethylphenyl)methyl-methylamino]-N-(2-methoxyphenyl)propanamide
CID 9045836
2-[(2,4-dimethylphenyl)methyl-methylamino]-N-(3-fluoro-4-methylphenyl)acetamide
CID 9045618
(2S)-N-[2-(2,6-dimethylanilino)-2-oxoethyl]-2-[(2,4-dimethylphenyl)methyl-methylamino]propanamide
CID 9045922
(2R)-N-(3,4-difluorophenyl)-2-(2,4-dimethylphenoxy)propanamide
CID 9173713
N-(3-fluoro-4-methylphenyl)-2-[3-hydroxybutyl(methyl)amino]propanamide
CID 111488702
N-(3,4-difluorophenyl)-2-[methyl(2-phenoxyethyl)amino]propanamide
CID 24506649
(2R)-N-(1,3-benzodioxol-5-yl)-2-[methyl-[(2-methylphenyl)methyl]amino]propanamide
CID 8516621

Frequently Asked Questions

What is the IUPAC name of N-(3,4-difluorophenyl)-2-[(2,4-dimethylphenyl)methyl-methylamino]propanamide?
The IUPAC name of N-(3,4-difluorophenyl)-2-[(2,4-dimethylphenyl)methyl-methylamino]propanamide (CID 46563659) is N-(3,4-difluorophenyl)-2-[(2,4-dimethylphenyl)methyl-methylamino]propanamide.
What is the SMILES notation for N-(3,4-difluorophenyl)-2-[(2,4-dimethylphenyl)methyl-methylamino]propanamide?
The canonical SMILES for N-(3,4-difluorophenyl)-2-[(2,4-dimethylphenyl)methyl-methylamino]propanamide is Cc1ccc(CN(C)C(C)C(=O)Nc2ccc(F)c(F)c2)c(C)c1.
What is the InChIKey of N-(3,4-difluorophenyl)-2-[(2,4-dimethylphenyl)methyl-methylamino]propanamide?
The InChIKey is OSLZFCOTGYCLDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22F2N2O/c1-12-5-6-15(13(2)9-12)11-23(4)14(3)19(24)22-16-7-8-17(20)18(21)10-16/h5-10,14H,11H2,1-4H3,(H,22,24).
What are the key properties of N-(3,4-difluorophenyl)-2-[(2,4-dimethylphenyl)methyl-methylamino]propanamide?
N-(3,4-difluorophenyl)-2-[(2,4-dimethylphenyl)methyl-methylamino]propanamide has a molecular weight of 332.39 g/mol, XLogP of 4.04, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-difluorophenyl)-2-[(2,4-dimethylphenyl)methyl-methylamino]propanamide is sourced from PubChem (CID 46563659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).