2,4-difluoro-N-(1-pyridin-4-ylethyl)benzamide

C14H12F2N2O — CID 43006008

IUPAC2,4-difluoro-N-(1-pyridin-4-ylethyl)benzamide
SMILESCC(NC(=O)c1ccc(F)cc1F)c1ccncc1
InChIInChI=1S/C14H12F2N2O/c1-9(10-4-6-17-7-5-10)18-14(19)12-3-2-11(15)8-13(12)16/h2-9H,1H3,(H,18,19)
InChIKeyVPAGOLNEUCAHFF-UHFFFAOYSA-N
MW262.26 g/mol
LogP2.85
Rot. Bonds3

About 2,4-difluoro-N-(1-pyridin-4-ylethyl)benzamide

2,4-difluoro-N-(1-pyridin-4-ylethyl)benzamide (PubChem CID 43006008) has the molecular formula C14H12F2N2O and a molecular weight of 262.26 g/mol. Its IUPAC name is 2,4-difluoro-N-(1-pyridin-4-ylethyl)benzamide.

Molecular Properties

Compound Name2,4-difluoro-N-(1-pyridin-4-ylethyl)benzamide
PubChem CID43006008
Molecular FormulaC14H12F2N2O
Molecular Weight262.26 g/mol
Exact Mass262.09
IUPAC Name2,4-difluoro-N-(1-pyridin-4-ylethyl)benzamide
SMILESCC(NC(=O)c1ccc(F)cc1F)c1ccncc1
InChIInChI=1S/C14H12F2N2O/c1-9(10-4-6-17-7-5-10)18-14(19)12-3-2-11(15)8-13(12)16/h2-9H,1H3,(H,18,19)
InChIKeyVPAGOLNEUCAHFF-UHFFFAOYSA-N
XLogP2.85
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.26
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-amino-2-fluoro-N-[(1S)-1-pyridin-4-ylethyl]benzamide
CID 107794749
2-fluoro-N-[(1S)-1-pyridin-4-ylethyl]benzamide
CID 40585288
2,4-difluoro-N-[(1S)-1-(4-methoxyphenyl)ethyl]benzamide
CID 28560292
5-amino-2,4-difluoro-N-(1-pyridin-4-ylethyl)benzamide
CID 61094421
N-[1-(2,4-difluorophenyl)ethyl]-2,4-difluorobenzamide
CID 51150419
2-fluoro-5-methyl-N-(1-pyridin-4-ylethyl)benzamide
CID 62511341
2-chloro-4,5-difluoro-N-(1-pyridin-4-ylethyl)benzamide
CID 2970246
1-(2,4-difluorobenzoyl)-N-(1-pyridin-4-ylethyl)piperidine-4-carboxamide
CID 24639274
2,3-dihydroxy-N-(1-pyridin-4-ylethyl)benzamide
CID 114343947
4-chloro-N-[(1R)-1-pyridin-4-ylethyl]benzamide
CID 40585280
4-chloro-2-fluoro-N-[(1R)-1-phenylethyl]benzamide
CID 26004040
2-fluoro-4-methyl-N-(1-phenylethyl)benzamide
CID 79770350

Frequently Asked Questions

What is the IUPAC name of 2,4-difluoro-N-(1-pyridin-4-ylethyl)benzamide?
The IUPAC name of 2,4-difluoro-N-(1-pyridin-4-ylethyl)benzamide (CID 43006008) is 2,4-difluoro-N-(1-pyridin-4-ylethyl)benzamide.
What is the SMILES notation for 2,4-difluoro-N-(1-pyridin-4-ylethyl)benzamide?
The canonical SMILES for 2,4-difluoro-N-(1-pyridin-4-ylethyl)benzamide is CC(NC(=O)c1ccc(F)cc1F)c1ccncc1.
What is the InChIKey of 2,4-difluoro-N-(1-pyridin-4-ylethyl)benzamide?
The InChIKey is VPAGOLNEUCAHFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12F2N2O/c1-9(10-4-6-17-7-5-10)18-14(19)12-3-2-11(15)8-13(12)16/h2-9H,1H3,(H,18,19).
What are the key properties of 2,4-difluoro-N-(1-pyridin-4-ylethyl)benzamide?
2,4-difluoro-N-(1-pyridin-4-ylethyl)benzamide has a molecular weight of 262.26 g/mol, XLogP of 2.85, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-difluoro-N-(1-pyridin-4-ylethyl)benzamide is sourced from PubChem (CID 43006008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).