2-amino-N-(3,5-difluorophenyl)-3-(4-hydroxyphenyl)propanamide

C15H14F2N2O2 — CID 76891970

IUPAC2-amino-N-(3,5-difluorophenyl)-3-(4-hydroxyphenyl)propanamide
SMILESNC(Cc1ccc(O)cc1)C(=O)Nc1cc(F)cc(F)c1
InChIInChI=1S/C15H14F2N2O2/c16-10-6-11(17)8-12(7-10)19-15(21)14(18)5-9-1-3-13(20)4-2-9/h1-4,6-8,14,20H,5,18H2,(H,19,21)
InChIKeyQFVNWLBDOSBFFG-UHFFFAOYSA-N
MW292.29 g/mol
LogP2.18
Rot. Bonds4

About 2-amino-N-(3,5-difluorophenyl)-3-(4-hydroxyphenyl)propanamide

2-amino-N-(3,5-difluorophenyl)-3-(4-hydroxyphenyl)propanamide (PubChem CID 76891970) has the molecular formula C15H14F2N2O2 and a molecular weight of 292.29 g/mol. Its IUPAC name is 2-amino-N-(3,5-difluorophenyl)-3-(4-hydroxyphenyl)propanamide.

Molecular Properties

Compound Name2-amino-N-(3,5-difluorophenyl)-3-(4-hydroxyphenyl)propanamide
PubChem CID76891970
Molecular FormulaC15H14F2N2O2
Molecular Weight292.29 g/mol
Exact Mass292.10
IUPAC Name2-amino-N-(3,5-difluorophenyl)-3-(4-hydroxyphenyl)propanamide
SMILESNC(Cc1ccc(O)cc1)C(=O)Nc1cc(F)cc(F)c1
InChIInChI=1S/C15H14F2N2O2/c16-10-6-11(17)8-12(7-10)19-15(21)14(18)5-9-1-3-13(20)4-2-9/h1-4,6-8,14,20H,5,18H2,(H,19,21)
InChIKeyQFVNWLBDOSBFFG-UHFFFAOYSA-N
XLogP2.18
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 ≤ 52.18
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-(3,5-difluorophenyl)-3-phenylpropanamide
CID 24703610
2-amino-N-(4-fluorophenyl)-3-(4-hydroxyphenyl)propanamide
CID 76891904
(2R)-2-amino-N-(3,4-difluorophenyl)-3-(4-hydroxyphenyl)propanamide
CID 104904585
(2R)-2-amino-N-(2-chloro-5-fluorophenyl)-3-(4-hydroxyphenyl)propanamide
CID 107528596
2-amino-N-(4-chloro-3-fluorophenyl)-3-(4-hydroxyphenyl)propanamide
CID 76887225
(2S)-2-amino-N-(3-chloro-5-fluorophenyl)-3-phenylpropanamide
CID 107365994
(2R)-2-amino-3-(4-hydroxyphenyl)-N-(4-methylsulfanylphenyl)propanamide
CID 104904568
(2R)-2-amino-N-(2-chloro-4-fluorophenyl)-3-(4-hydroxyphenyl)propanamide
CID 104904689
2-amino-N-(2-chloro-4-fluorophenyl)-3-(4-hydroxyphenyl)propanamide
CID 76892216
(2R)-2-amino-N-(4-hydroxy-3-methylphenyl)-3-(4-hydroxyphenyl)propanamide
CID 104905420
(2R)-2-amino-N-[3-(hydroxymethyl)phenyl]-3-(4-hydroxyphenyl)propanamide
CID 104904818
(2S)-2-amino-N-(3-fluorophenyl)-3-phenylpropanamide
CID 22691298

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(3,5-difluorophenyl)-3-(4-hydroxyphenyl)propanamide?
The IUPAC name of 2-amino-N-(3,5-difluorophenyl)-3-(4-hydroxyphenyl)propanamide (CID 76891970) is 2-amino-N-(3,5-difluorophenyl)-3-(4-hydroxyphenyl)propanamide.
What is the SMILES notation for 2-amino-N-(3,5-difluorophenyl)-3-(4-hydroxyphenyl)propanamide?
The canonical SMILES for 2-amino-N-(3,5-difluorophenyl)-3-(4-hydroxyphenyl)propanamide is NC(Cc1ccc(O)cc1)C(=O)Nc1cc(F)cc(F)c1.
What is the InChIKey of 2-amino-N-(3,5-difluorophenyl)-3-(4-hydroxyphenyl)propanamide?
The InChIKey is QFVNWLBDOSBFFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14F2N2O2/c16-10-6-11(17)8-12(7-10)19-15(21)14(18)5-9-1-3-13(20)4-2-9/h1-4,6-8,14,20H,5,18H2,(H,19,21).
What are the key properties of 2-amino-N-(3,5-difluorophenyl)-3-(4-hydroxyphenyl)propanamide?
2-amino-N-(3,5-difluorophenyl)-3-(4-hydroxyphenyl)propanamide has a molecular weight of 292.29 g/mol, XLogP of 2.18, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(3,5-difluorophenyl)-3-(4-hydroxyphenyl)propanamide is sourced from PubChem (CID 76891970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).