N-(2-fluorophenyl)-3-[(2-fluorophenyl)methyl-methylamino]propanamide

C17H18F2N2O — CID 24588973

IUPACN-(2-fluorophenyl)-3-[(2-fluorophenyl)methyl-methylamino]propanamide
SMILESCN(CCC(=O)Nc1ccccc1F)Cc1ccccc1F
InChIInChI=1S/C17H18F2N2O/c1-21(12-13-6-2-3-7-14(13)18)11-10-17(22)20-16-9-5-4-8-15(16)19/h2-9H,10-12H2,1H3,(H,20,22)
InChIKeyOVVLGBWTKCHVTR-UHFFFAOYSA-N
MW304.34 g/mol
LogP3.43
Rot. Bonds6

About N-(2-fluorophenyl)-3-[(2-fluorophenyl)methyl-methylamino]propanamide

N-(2-fluorophenyl)-3-[(2-fluorophenyl)methyl-methylamino]propanamide (PubChem CID 24588973) has the molecular formula C17H18F2N2O and a molecular weight of 304.34 g/mol. Its IUPAC name is N-(2-fluorophenyl)-3-[(2-fluorophenyl)methyl-methylamino]propanamide.

Molecular Properties

Compound NameN-(2-fluorophenyl)-3-[(2-fluorophenyl)methyl-methylamino]propanamide
PubChem CID24588973
Molecular FormulaC17H18F2N2O
Molecular Weight304.34 g/mol
Exact Mass304.14
IUPAC NameN-(2-fluorophenyl)-3-[(2-fluorophenyl)methyl-methylamino]propanamide
SMILESCN(CCC(=O)Nc1ccccc1F)Cc1ccccc1F
InChIInChI=1S/C17H18F2N2O/c1-21(12-13-6-2-3-7-14(13)18)11-10-17(22)20-16-9-5-4-8-15(16)19/h2-9H,10-12H2,1H3,(H,20,22)
InChIKeyOVVLGBWTKCHVTR-UHFFFAOYSA-N
XLogP3.43
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.34
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-fluorophenyl)-3-[5-hydroxypentyl(methyl)amino]propanamide
CID 107204141
3-[[2-(2-fluoroanilino)-2-oxoethyl]-methylamino]propanoic acid
CID 60987825
3-[(5-chlorothiophen-2-yl)methyl-methylamino]-N-(2-fluorophenyl)propanamide
CID 24589254
3-[acetyl-[(2-chlorophenyl)methyl]amino]-N-(2-fluorophenyl)propanamide
CID 113119498
3-[acetyl-[(2-fluorophenyl)methyl]amino]-N-(2-bromophenyl)propanamide
CID 113119208
3-[(2-fluorophenyl)methyl-methylamino]propanamide
CID 60647903
N-(2-fluorophenyl)butanamide
CID 849021
2-[(2-fluorophenyl)methyl-methylamino]-N-(2-methoxyphenyl)acetamide
CID 8005528
3-[acetyl-[(2-fluorophenyl)methyl]amino]-N-(2,4-difluorophenyl)propanamide
CID 113119215
(2R)-N-(2-fluorophenyl)-2-[(2-fluorophenyl)methyl-methylamino]propanamide
CID 8517819
3-[bis(2-methylpropyl)amino]-N-(2-fluorophenyl)propanamide
CID 52675226
(2S)-N-(2-fluorophenyl)-2-[(2-fluorophenyl)methyl-methylamino]propanamide
CID 8517815

Frequently Asked Questions

What is the IUPAC name of N-(2-fluorophenyl)-3-[(2-fluorophenyl)methyl-methylamino]propanamide?
The IUPAC name of N-(2-fluorophenyl)-3-[(2-fluorophenyl)methyl-methylamino]propanamide (CID 24588973) is N-(2-fluorophenyl)-3-[(2-fluorophenyl)methyl-methylamino]propanamide.
What is the SMILES notation for N-(2-fluorophenyl)-3-[(2-fluorophenyl)methyl-methylamino]propanamide?
The canonical SMILES for N-(2-fluorophenyl)-3-[(2-fluorophenyl)methyl-methylamino]propanamide is CN(CCC(=O)Nc1ccccc1F)Cc1ccccc1F.
What is the InChIKey of N-(2-fluorophenyl)-3-[(2-fluorophenyl)methyl-methylamino]propanamide?
The InChIKey is OVVLGBWTKCHVTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18F2N2O/c1-21(12-13-6-2-3-7-14(13)18)11-10-17(22)20-16-9-5-4-8-15(16)19/h2-9H,10-12H2,1H3,(H,20,22).
What are the key properties of N-(2-fluorophenyl)-3-[(2-fluorophenyl)methyl-methylamino]propanamide?
N-(2-fluorophenyl)-3-[(2-fluorophenyl)methyl-methylamino]propanamide has a molecular weight of 304.34 g/mol, XLogP of 3.43, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluorophenyl)-3-[(2-fluorophenyl)methyl-methylamino]propanamide is sourced from PubChem (CID 24588973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).