2,3-difluoro-N-methyl-N-(pyridin-4-ylmethyl)benzamide

C14H12F2N2O — CID 62649865

IUPAC2,3-difluoro-N-methyl-N-(pyridin-4-ylmethyl)benzamide
SMILESCN(Cc1ccncc1)C(=O)c1cccc(F)c1F
InChIInChI=1S/C14H12F2N2O/c1-18(9-10-5-7-17-8-6-10)14(19)11-3-2-4-12(15)13(11)16/h2-8H,9H2,1H3
InChIKeyLWGMYPDCIAJICS-UHFFFAOYSA-N
MW262.26 g/mol
LogP2.63
Rot. Bonds3

About 2,3-difluoro-N-methyl-N-(pyridin-4-ylmethyl)benzamide

2,3-difluoro-N-methyl-N-(pyridin-4-ylmethyl)benzamide (PubChem CID 62649865) has the molecular formula C14H12F2N2O and a molecular weight of 262.26 g/mol. Its IUPAC name is 2,3-difluoro-N-methyl-N-(pyridin-4-ylmethyl)benzamide.

Molecular Properties

Compound Name2,3-difluoro-N-methyl-N-(pyridin-4-ylmethyl)benzamide
PubChem CID62649865
Molecular FormulaC14H12F2N2O
Molecular Weight262.26 g/mol
Exact Mass262.09
IUPAC Name2,3-difluoro-N-methyl-N-(pyridin-4-ylmethyl)benzamide
SMILESCN(Cc1ccncc1)C(=O)c1cccc(F)c1F
InChIInChI=1S/C14H12F2N2O/c1-18(9-10-5-7-17-8-6-10)14(19)11-3-2-4-12(15)13(11)16/h2-8H,9H2,1H3
InChIKeyLWGMYPDCIAJICS-UHFFFAOYSA-N
XLogP2.63
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.26
LogP ≤ 52.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-amino-3-fluoro-N-methyl-N-(pyridin-4-ylmethyl)benzamide
CID 62662222
5-chloro-2-fluoro-N-methyl-N-(pyridin-4-ylmethyl)benzamide
CID 53016447
2-bromo-N,3-dimethyl-N-(pyridin-4-ylmethyl)benzamide
CID 103853024
2,3-difluoro-N-methyl-N-[(1-methylimidazol-2-yl)methyl]benzamide
CID 62662294
2,3-difluoro-N-methyl-N-propylbenzamide
CID 62649186
2-fluoro-N-[(4-fluorophenyl)methyl]-N,3-dimethylbenzamide
CID 80718972
4-fluoro-N,2-dimethyl-N-(pyridin-4-ylmethyl)benzamide
CID 112702339
3-fluoro-N-methyl-N-(pyridin-3-ylmethyl)pyridine-4-carboxamide
CID 113240917
N-[(2,4-difluorophenyl)methyl]-2,3-difluoro-N-methylbenzamide
CID 62649068
2,3-difluoro-N-(2-hydroxypropyl)-N-methylbenzamide
CID 55110703
N-[[4-(aminomethyl)phenyl]methyl]-2-fluoro-N,3-dimethylbenzamide
CID 81479696
4-amino-3,5-difluoro-N-methyl-N-(pyridin-4-ylmethyl)benzamide
CID 63185451

Frequently Asked Questions

What is the IUPAC name of 2,3-difluoro-N-methyl-N-(pyridin-4-ylmethyl)benzamide?
The IUPAC name of 2,3-difluoro-N-methyl-N-(pyridin-4-ylmethyl)benzamide (CID 62649865) is 2,3-difluoro-N-methyl-N-(pyridin-4-ylmethyl)benzamide.
What is the SMILES notation for 2,3-difluoro-N-methyl-N-(pyridin-4-ylmethyl)benzamide?
The canonical SMILES for 2,3-difluoro-N-methyl-N-(pyridin-4-ylmethyl)benzamide is CN(Cc1ccncc1)C(=O)c1cccc(F)c1F.
What is the InChIKey of 2,3-difluoro-N-methyl-N-(pyridin-4-ylmethyl)benzamide?
The InChIKey is LWGMYPDCIAJICS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12F2N2O/c1-18(9-10-5-7-17-8-6-10)14(19)11-3-2-4-12(15)13(11)16/h2-8H,9H2,1H3.
What are the key properties of 2,3-difluoro-N-methyl-N-(pyridin-4-ylmethyl)benzamide?
2,3-difluoro-N-methyl-N-(pyridin-4-ylmethyl)benzamide has a molecular weight of 262.26 g/mol, XLogP of 2.63, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-difluoro-N-methyl-N-(pyridin-4-ylmethyl)benzamide is sourced from PubChem (CID 62649865), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).