2,4-difluoro-5-[1-(3-hydroxyphenyl)ethylamino]benzamide

C15H14F2N2O2 — CID 43673811

IUPAC2,4-difluoro-5-[1-(3-hydroxyphenyl)ethylamino]benzamide
SMILESCC(Nc1cc(C(N)=O)c(F)cc1F)c1cccc(O)c1
InChIInChI=1S/C15H14F2N2O2/c1-8(9-3-2-4-10(20)5-9)19-14-6-11(15(18)21)12(16)7-13(14)17/h2-8,19-20H,1H3,(H2,18,21)
InChIKeyPEFSKIQLJLXGJI-UHFFFAOYSA-N
MW292.29 g/mol
LogP2.94
Rot. Bonds4

About 2,4-difluoro-5-[1-(3-hydroxyphenyl)ethylamino]benzamide

2,4-difluoro-5-[1-(3-hydroxyphenyl)ethylamino]benzamide (PubChem CID 43673811) has the molecular formula C15H14F2N2O2 and a molecular weight of 292.29 g/mol. Its IUPAC name is 2,4-difluoro-5-[1-(3-hydroxyphenyl)ethylamino]benzamide.

Molecular Properties

Compound Name2,4-difluoro-5-[1-(3-hydroxyphenyl)ethylamino]benzamide
PubChem CID43673811
Molecular FormulaC15H14F2N2O2
Molecular Weight292.29 g/mol
Exact Mass292.10
IUPAC Name2,4-difluoro-5-[1-(3-hydroxyphenyl)ethylamino]benzamide
SMILESCC(Nc1cc(C(N)=O)c(F)cc1F)c1cccc(O)c1
InChIInChI=1S/C15H14F2N2O2/c1-8(9-3-2-4-10(20)5-9)19-14-6-11(15(18)21)12(16)7-13(14)17/h2-8,19-20H,1H3,(H2,18,21)
InChIKeyPEFSKIQLJLXGJI-UHFFFAOYSA-N
XLogP2.94
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.29
LogP ≤ 52.94
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2,4-difluoro-5-[1-(4-hydroxyphenyl)ethylamino]benzamide
CID 43673790
2,4-difluoro-5-[1-(3-methylthiophen-2-yl)ethylamino]benzamide
CID 63990643
3-[1-(2-fluoro-4-hydroxyphenyl)ethylamino]-2-methylbenzamide
CID 107714808
2,4-difluoro-5-(4-methylpentan-2-ylamino)benzamide
CID 43673793
[(1S)-1-(3-hydroxyphenyl)ethyl]urea
CID 130686101
2-[1-(3-hydroxyphenyl)ethylamino]-N,N-dimethylbenzamide
CID 43738358
5-[1-(2,4-dimethyl-1,3-thiazol-5-yl)ethylamino]-2,4-difluorobenzamide
CID 63751916
2-fluoro-4-[1-(3-hydroxyphenyl)ethylamino]phenol
CID 64793713
2-[1-(3-aminophenyl)ethylamino]-5-chlorobenzamide
CID 62495061
methyl 2-(5-carbamoyl-2,4-difluoroanilino)butanoate
CID 115352435
2,4-difluoro-5-(heptan-2-ylamino)benzamide
CID 43673685
methyl 2,4-difluoro-5-(1-thiophen-3-ylethylamino)benzoate
CID 62091574

Frequently Asked Questions

What is the IUPAC name of 2,4-difluoro-5-[1-(3-hydroxyphenyl)ethylamino]benzamide?
The IUPAC name of 2,4-difluoro-5-[1-(3-hydroxyphenyl)ethylamino]benzamide (CID 43673811) is 2,4-difluoro-5-[1-(3-hydroxyphenyl)ethylamino]benzamide.
What is the SMILES notation for 2,4-difluoro-5-[1-(3-hydroxyphenyl)ethylamino]benzamide?
The canonical SMILES for 2,4-difluoro-5-[1-(3-hydroxyphenyl)ethylamino]benzamide is CC(Nc1cc(C(N)=O)c(F)cc1F)c1cccc(O)c1.
What is the InChIKey of 2,4-difluoro-5-[1-(3-hydroxyphenyl)ethylamino]benzamide?
The InChIKey is PEFSKIQLJLXGJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14F2N2O2/c1-8(9-3-2-4-10(20)5-9)19-14-6-11(15(18)21)12(16)7-13(14)17/h2-8,19-20H,1H3,(H2,18,21).
What are the key properties of 2,4-difluoro-5-[1-(3-hydroxyphenyl)ethylamino]benzamide?
2,4-difluoro-5-[1-(3-hydroxyphenyl)ethylamino]benzamide has a molecular weight of 292.29 g/mol, XLogP of 2.94, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-difluoro-5-[1-(3-hydroxyphenyl)ethylamino]benzamide is sourced from PubChem (CID 43673811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).