N-[1-(2-fluorophenyl)ethyl]-5-methyl-2-(methylamino)benzamide

C17H19FN2O — CID 62508680

IUPACN-[1-(2-fluorophenyl)ethyl]-5-methyl-2-(methylamino)benzamide
SMILESCNc1ccc(C)cc1C(=O)NC(C)c1ccccc1F
InChIInChI=1S/C17H19FN2O/c1-11-8-9-16(19-3)14(10-11)17(21)20-12(2)13-6-4-5-7-15(13)18/h4-10,12,19H,1-3H3,(H,20,21)
InChIKeyVIOZMUANCNSPNR-UHFFFAOYSA-N
MW286.35 g/mol
LogP3.67
Rot. Bonds4

About N-[1-(2-fluorophenyl)ethyl]-5-methyl-2-(methylamino)benzamide

N-[1-(2-fluorophenyl)ethyl]-5-methyl-2-(methylamino)benzamide (PubChem CID 62508680) has the molecular formula C17H19FN2O and a molecular weight of 286.35 g/mol. Its IUPAC name is N-[1-(2-fluorophenyl)ethyl]-5-methyl-2-(methylamino)benzamide.

Molecular Properties

Compound NameN-[1-(2-fluorophenyl)ethyl]-5-methyl-2-(methylamino)benzamide
PubChem CID62508680
Molecular FormulaC17H19FN2O
Molecular Weight286.35 g/mol
Exact Mass286.15
IUPAC NameN-[1-(2-fluorophenyl)ethyl]-5-methyl-2-(methylamino)benzamide
SMILESCNc1ccc(C)cc1C(=O)NC(C)c1ccccc1F
InChIInChI=1S/C17H19FN2O/c1-11-8-9-16(19-3)14(10-11)17(21)20-12(2)13-6-4-5-7-15(13)18/h4-10,12,19H,1-3H3,(H,20,21)
InChIKeyVIOZMUANCNSPNR-UHFFFAOYSA-N
XLogP3.67
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.35
LogP ≤ 53.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-fluoro-4-methyl-N-[1-(2-methylphenyl)ethyl]benzamide
CID 79770895
2,5-dimethyl-N-[(1S)-1-(2-methylphenyl)ethyl]benzamide
CID 31178331
5-amino-2,4-difluoro-N-[1-(2-fluorophenyl)ethyl]benzamide
CID 61117350
N-[(1R)-1-(2-fluorophenyl)ethyl]-2-methyl-5-(methylsulfamoyl)benzamide
CID 51928644
2-fluoro-4-methyl-N-(1-phenylethyl)benzamide
CID 79770350
N-[1-(2-fluorophenyl)ethyl]-2,3-dihydroxybenzamide
CID 114344109
3-amino-N-[1-(2-fluorophenyl)ethyl]-2-methylbenzamide
CID 61118167
2,3-difluoro-N-[1-(2-fluorophenyl)ethyl]pyridine-4-carboxamide
CID 105380534
5-methyl-2-(methylamino)-N-[1-(1H-1,2,4-triazol-5-yl)ethyl]benzamide
CID 106283670
N-[1-(2-aminophenyl)ethyl]-2,5-dimethylbenzamide
CID 43297799
2-bromo-N-[1-(2-bromophenyl)ethyl]-5-methylbenzamide
CID 81110213
5-amino-N-[1-(2-fluorophenyl)ethyl]-2-methylpyridine-3-carboxamide
CID 61117008

Frequently Asked Questions

What is the IUPAC name of N-[1-(2-fluorophenyl)ethyl]-5-methyl-2-(methylamino)benzamide?
The IUPAC name of N-[1-(2-fluorophenyl)ethyl]-5-methyl-2-(methylamino)benzamide (CID 62508680) is N-[1-(2-fluorophenyl)ethyl]-5-methyl-2-(methylamino)benzamide.
What is the SMILES notation for N-[1-(2-fluorophenyl)ethyl]-5-methyl-2-(methylamino)benzamide?
The canonical SMILES for N-[1-(2-fluorophenyl)ethyl]-5-methyl-2-(methylamino)benzamide is CNc1ccc(C)cc1C(=O)NC(C)c1ccccc1F.
What is the InChIKey of N-[1-(2-fluorophenyl)ethyl]-5-methyl-2-(methylamino)benzamide?
The InChIKey is VIOZMUANCNSPNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19FN2O/c1-11-8-9-16(19-3)14(10-11)17(21)20-12(2)13-6-4-5-7-15(13)18/h4-10,12,19H,1-3H3,(H,20,21).
What are the key properties of N-[1-(2-fluorophenyl)ethyl]-5-methyl-2-(methylamino)benzamide?
N-[1-(2-fluorophenyl)ethyl]-5-methyl-2-(methylamino)benzamide has a molecular weight of 286.35 g/mol, XLogP of 3.67, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2-fluorophenyl)ethyl]-5-methyl-2-(methylamino)benzamide is sourced from PubChem (CID 62508680), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).