N-(2-amino-2-phenylethyl)-2,5-difluorobenzamide

C15H14F2N2O — CID 63120448

IUPACN-(2-amino-2-phenylethyl)-2,5-difluorobenzamide
SMILESNC(CNC(=O)c1cc(F)ccc1F)c1ccccc1
InChIInChI=1S/C15H14F2N2O/c16-11-6-7-13(17)12(8-11)15(20)19-9-14(18)10-4-2-1-3-5-10/h1-8,14H,9,18H2,(H,19,20)
InChIKeySLBBEMCDEHGWSN-UHFFFAOYSA-N
MW276.29 g/mol
LogP2.39
Rot. Bonds4

About N-(2-amino-2-phenylethyl)-2,5-difluorobenzamide

N-(2-amino-2-phenylethyl)-2,5-difluorobenzamide (PubChem CID 63120448) has the molecular formula C15H14F2N2O and a molecular weight of 276.29 g/mol. Its IUPAC name is N-(2-amino-2-phenylethyl)-2,5-difluorobenzamide.

Molecular Properties

Compound NameN-(2-amino-2-phenylethyl)-2,5-difluorobenzamide
PubChem CID63120448
Molecular FormulaC15H14F2N2O
Molecular Weight276.29 g/mol
Exact Mass276.11
IUPAC NameN-(2-amino-2-phenylethyl)-2,5-difluorobenzamide
SMILESNC(CNC(=O)c1cc(F)ccc1F)c1ccccc1
InChIInChI=1S/C15H14F2N2O/c16-11-6-7-13(17)12(8-11)15(20)19-9-14(18)10-4-2-1-3-5-10/h1-8,14H,9,18H2,(H,19,20)
InChIKeySLBBEMCDEHGWSN-UHFFFAOYSA-N
XLogP2.39
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.29
LogP ≤ 52.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-amino-3-phenylpropyl)-2,5-difluorobenzamide
CID 80506852
2,5-difluoro-N-[(2R)-2-phenylbutyl]benzamide
CID 26687345
N-(2-amino-2-phenylethyl)-2,6-difluorobenzamide
CID 63120453
N-(2-amino-2-phenylethyl)-3-bromo-4-fluorobenzamide
CID 103806531
N-(2-amino-2-phenylethyl)-2-methylsulfanylbenzamide
CID 79217268
N-(2-amino-2-phenylethyl)-3-fluoro-4-methylbenzamide
CID 63120380
2,5-difluoro-N-(3,3,3-trifluoro-2-hydroxypropyl)benzamide
CID 113248488
N-(2-amino-2-phenylethyl)-2,5-dibromobenzamide
CID 114374319
N-(2-amino-2-phenylethyl)-6-methyl-4-oxo-1H-pyridine-3-carboxamide
CID 103806521
(2-amino-2-phenylethyl)carbamic acid
CID 66941802
N-[(2R)-2-(ethylamino)propyl]-2,5-difluorobenzamide
CID 120651737
N-(2-amino-2-phenylethyl)-2-nitrobenzamide
CID 63120393

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-2-phenylethyl)-2,5-difluorobenzamide?
The IUPAC name of N-(2-amino-2-phenylethyl)-2,5-difluorobenzamide (CID 63120448) is N-(2-amino-2-phenylethyl)-2,5-difluorobenzamide.
What is the SMILES notation for N-(2-amino-2-phenylethyl)-2,5-difluorobenzamide?
The canonical SMILES for N-(2-amino-2-phenylethyl)-2,5-difluorobenzamide is NC(CNC(=O)c1cc(F)ccc1F)c1ccccc1.
What is the InChIKey of N-(2-amino-2-phenylethyl)-2,5-difluorobenzamide?
The InChIKey is SLBBEMCDEHGWSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14F2N2O/c16-11-6-7-13(17)12(8-11)15(20)19-9-14(18)10-4-2-1-3-5-10/h1-8,14H,9,18H2,(H,19,20).
What are the key properties of N-(2-amino-2-phenylethyl)-2,5-difluorobenzamide?
N-(2-amino-2-phenylethyl)-2,5-difluorobenzamide has a molecular weight of 276.29 g/mol, XLogP of 2.39, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-2-phenylethyl)-2,5-difluorobenzamide is sourced from PubChem (CID 63120448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).