N-[4-fluoro-3-[1-(3-methylphenyl)ethylamino]phenyl]acetamide

C17H19FN2O — CID 43778944

IUPACN-[4-fluoro-3-[1-(3-methylphenyl)ethylamino]phenyl]acetamide
SMILESCC(=O)Nc1ccc(F)c(NC(C)c2cccc(C)c2)c1
InChIInChI=1S/C17H19FN2O/c1-11-5-4-6-14(9-11)12(2)19-17-10-15(20-13(3)21)7-8-16(17)18/h4-10,12,19H,1-3H3,(H,20,21)
InChIKeyAOPSWLVGYZKZHQ-UHFFFAOYSA-N
MW286.35 g/mol
LogP4.27
Rot. Bonds4

About N-[4-fluoro-3-[1-(3-methylphenyl)ethylamino]phenyl]acetamide

N-[4-fluoro-3-[1-(3-methylphenyl)ethylamino]phenyl]acetamide (PubChem CID 43778944) has the molecular formula C17H19FN2O and a molecular weight of 286.35 g/mol. Its IUPAC name is N-[4-fluoro-3-[1-(3-methylphenyl)ethylamino]phenyl]acetamide.

Molecular Properties

Compound NameN-[4-fluoro-3-[1-(3-methylphenyl)ethylamino]phenyl]acetamide
PubChem CID43778944
Molecular FormulaC17H19FN2O
Molecular Weight286.35 g/mol
Exact Mass286.15
IUPAC NameN-[4-fluoro-3-[1-(3-methylphenyl)ethylamino]phenyl]acetamide
SMILESCC(=O)Nc1ccc(F)c(NC(C)c2cccc(C)c2)c1
InChIInChI=1S/C17H19FN2O/c1-11-5-4-6-14(9-11)12(2)19-17-10-15(20-13(3)21)7-8-16(17)18/h4-10,12,19H,1-3H3,(H,20,21)
InChIKeyAOPSWLVGYZKZHQ-UHFFFAOYSA-N
XLogP4.27
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 ≤ 54.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[4-methyl-3-[1-(3-methylphenyl)ethylamino]phenyl]acetamide
CID 43789836
N-[3-[1-(2-fluoroanilino)ethyl]phenyl]acetamide
CID 43201351
N-[4-fluoro-3-[1-(3-methylpyrazin-2-yl)ethylamino]phenyl]acetamide
CID 102613382
N-[2-fluoro-5-(1-pyridin-4-ylethylamino)phenyl]acetamide
CID 60927576
N-[4-fluoro-3-(pentan-3-ylamino)phenyl]acetamide
CID 43672597
N-[4-fluoro-3-(5-methylhexan-2-ylamino)phenyl]acetamide
CID 43672568
2-fluoro-N-[1-(3-methoxyphenyl)ethyl]-5-methylaniline
CID 43122780
N-[2-fluoro-5-[1-(4-hydroxyphenyl)ethylamino]phenyl]acetamide
CID 60927140
N-[3-[1-(2-iodoanilino)ethyl]phenyl]acetamide
CID 43124690
2-(5-acetamido-2-fluoroanilino)butanoic acid
CID 115352424
N-[3-[1-[(5-methylpyrimidin-2-yl)amino]ethyl]phenyl]acetamide
CID 63208430
N-[4-fluoro-3-(hexan-2-ylamino)phenyl]acetamide
CID 43778939

Frequently Asked Questions

What is the IUPAC name of N-[4-fluoro-3-[1-(3-methylphenyl)ethylamino]phenyl]acetamide?
The IUPAC name of N-[4-fluoro-3-[1-(3-methylphenyl)ethylamino]phenyl]acetamide (CID 43778944) is N-[4-fluoro-3-[1-(3-methylphenyl)ethylamino]phenyl]acetamide.
What is the SMILES notation for N-[4-fluoro-3-[1-(3-methylphenyl)ethylamino]phenyl]acetamide?
The canonical SMILES for N-[4-fluoro-3-[1-(3-methylphenyl)ethylamino]phenyl]acetamide is CC(=O)Nc1ccc(F)c(NC(C)c2cccc(C)c2)c1.
What is the InChIKey of N-[4-fluoro-3-[1-(3-methylphenyl)ethylamino]phenyl]acetamide?
The InChIKey is AOPSWLVGYZKZHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19FN2O/c1-11-5-4-6-14(9-11)12(2)19-17-10-15(20-13(3)21)7-8-16(17)18/h4-10,12,19H,1-3H3,(H,20,21).
What are the key properties of N-[4-fluoro-3-[1-(3-methylphenyl)ethylamino]phenyl]acetamide?
N-[4-fluoro-3-[1-(3-methylphenyl)ethylamino]phenyl]acetamide has a molecular weight of 286.35 g/mol, XLogP of 4.27, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-fluoro-3-[1-(3-methylphenyl)ethylamino]phenyl]acetamide is sourced from PubChem (CID 43778944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).