2-[1-(2-fluorophenyl)ethylamino]-N-naphthalen-2-ylpropanamide

C21H21FN2O — CID 18289661

IUPAC2-[1-(2-fluorophenyl)ethylamino]-N-naphthalen-2-ylpropanamide
SMILESCC(NC(C)c1ccccc1F)C(=O)Nc1ccc2ccccc2c1
InChIInChI=1S/C21H21FN2O/c1-14(19-9-5-6-10-20(19)22)23-15(2)21(25)24-18-12-11-16-7-3-4-8-17(16)13-18/h3-15,23H,1-2H3,(H,24,25)
InChIKeyQMZQHDICLWFMFU-UHFFFAOYSA-N
MW336.41 g/mol
LogP4.66
Rot. Bonds5

About 2-[1-(2-fluorophenyl)ethylamino]-N-naphthalen-2-ylpropanamide

2-[1-(2-fluorophenyl)ethylamino]-N-naphthalen-2-ylpropanamide (PubChem CID 18289661) has the molecular formula C21H21FN2O and a molecular weight of 336.41 g/mol. Its IUPAC name is 2-[1-(2-fluorophenyl)ethylamino]-N-naphthalen-2-ylpropanamide.

Molecular Properties

Compound Name2-[1-(2-fluorophenyl)ethylamino]-N-naphthalen-2-ylpropanamide
PubChem CID18289661
Molecular FormulaC21H21FN2O
Molecular Weight336.41 g/mol
Exact Mass336.16
IUPAC Name2-[1-(2-fluorophenyl)ethylamino]-N-naphthalen-2-ylpropanamide
SMILESCC(NC(C)c1ccccc1F)C(=O)Nc1ccc2ccccc2c1
InChIInChI=1S/C21H21FN2O/c1-14(19-9-5-6-10-20(19)22)23-15(2)21(25)24-18-12-11-16-7-3-4-8-17(16)13-18/h3-15,23H,1-2H3,(H,24,25)
InChIKeyQMZQHDICLWFMFU-UHFFFAOYSA-N
XLogP4.66
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.41
LogP ≤ 54.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3-fluoro-4-methylanilino)-N-naphthalen-2-ylpropanamide
CID 78708039
2-[1-(2-fluorophenyl)ethylamino]-N-(3-methyl-1,2-oxazol-5-yl)propanamide
CID 42896225
methyl 2-[[(1R)-1-(2-fluorophenyl)ethyl]amino]propanoate
CID 81380721
methyl (2S)-2-[1-(2-fluorophenyl)ethylamino]propanoate
CID 43225088
2-(3,4-dimethylanilino)-N-naphthalen-2-ylpropanamide
CID 78666889
2-(benzylamino)-N-naphthalen-2-ylpropanamide
CID 4870007
(2S)-N-(3,5-dimethoxyphenyl)-2-[[(1R)-1-naphthalen-1-ylethyl]amino]propanamide
CID 40800165
(2R)-2-amino-3-methyl-N-naphthalen-2-ylbutanamide
CID 671224
2,3,3-trifluoro-N-naphthalen-2-ylpropanamide
CID 175396381
(2R)-2-(4-fluorophenoxy)-N-naphthalen-2-ylpropanamide
CID 887383
4-[2-(1-naphthalen-1-ylethylamino)propanoylamino]benzamide
CID 86976453
(2S)-2,4-dimethyl-N-naphthalen-2-ylpentanamide
CID 58642005

Frequently Asked Questions

What is the IUPAC name of 2-[1-(2-fluorophenyl)ethylamino]-N-naphthalen-2-ylpropanamide?
The IUPAC name of 2-[1-(2-fluorophenyl)ethylamino]-N-naphthalen-2-ylpropanamide (CID 18289661) is 2-[1-(2-fluorophenyl)ethylamino]-N-naphthalen-2-ylpropanamide.
What is the SMILES notation for 2-[1-(2-fluorophenyl)ethylamino]-N-naphthalen-2-ylpropanamide?
The canonical SMILES for 2-[1-(2-fluorophenyl)ethylamino]-N-naphthalen-2-ylpropanamide is CC(NC(C)c1ccccc1F)C(=O)Nc1ccc2ccccc2c1.
What is the InChIKey of 2-[1-(2-fluorophenyl)ethylamino]-N-naphthalen-2-ylpropanamide?
The InChIKey is QMZQHDICLWFMFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H21FN2O/c1-14(19-9-5-6-10-20(19)22)23-15(2)21(25)24-18-12-11-16-7-3-4-8-17(16)13-18/h3-15,23H,1-2H3,(H,24,25).
What are the key properties of 2-[1-(2-fluorophenyl)ethylamino]-N-naphthalen-2-ylpropanamide?
2-[1-(2-fluorophenyl)ethylamino]-N-naphthalen-2-ylpropanamide has a molecular weight of 336.41 g/mol, XLogP of 4.66, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(2-fluorophenyl)ethylamino]-N-naphthalen-2-ylpropanamide is sourced from PubChem (CID 18289661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).