4-fluoro-N,2-dimethyl-N-pyridin-4-ylbenzamide

C14H13FN2O — CID 106934866

IUPAC4-fluoro-N,2-dimethyl-N-pyridin-4-ylbenzamide
SMILESCc1cc(F)ccc1C(=O)N(C)c1ccncc1
InChIInChI=1S/C14H13FN2O/c1-10-9-11(15)3-4-13(10)14(18)17(2)12-5-7-16-8-6-12/h3-9H,1-2H3
InChIKeyJZWBIUIWQWMQJM-UHFFFAOYSA-N
MW244.27 g/mol
LogP2.81
Rot. Bonds2

About 4-fluoro-N,2-dimethyl-N-pyridin-4-ylbenzamide

4-fluoro-N,2-dimethyl-N-pyridin-4-ylbenzamide (PubChem CID 106934866) has the molecular formula C14H13FN2O and a molecular weight of 244.27 g/mol. Its IUPAC name is 4-fluoro-N,2-dimethyl-N-pyridin-4-ylbenzamide.

Molecular Properties

Compound Name4-fluoro-N,2-dimethyl-N-pyridin-4-ylbenzamide
PubChem CID106934866
Molecular FormulaC14H13FN2O
Molecular Weight244.27 g/mol
Exact Mass244.10
IUPAC Name4-fluoro-N,2-dimethyl-N-pyridin-4-ylbenzamide
SMILESCc1cc(F)ccc1C(=O)N(C)c1ccncc1
InChIInChI=1S/C14H13FN2O/c1-10-9-11(15)3-4-13(10)14(18)17(2)12-5-7-16-8-6-12/h3-9H,1-2H3
InChIKeyJZWBIUIWQWMQJM-UHFFFAOYSA-N
XLogP2.81
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.27
LogP ≤ 52.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

5-fluoro-2-hydroxy-N-methyl-N-pyridin-4-ylbenzamide
CID 106936071
4-fluoro-N,2-dimethyl-N-(pyridin-4-ylmethyl)benzamide
CID 112702339
4-fluoro-N,2-dimethyl-N-(1-pyridin-4-ylethyl)benzamide
CID 115745848
4-fluoro-N,N,2-trimethylbenzamide
CID 115745346
2,4-diamino-N-methyl-N-pyridin-4-ylbenzamide
CID 106934261
N,4-dimethyl-2-(methylamino)-N-pyridin-4-ylbenzamide
CID 106937217
2-bromo-4-fluoro-N-(4-fluorophenyl)-N-methylbenzamide
CID 61063397
N-cyclopropyl-4-fluoro-N,2-dimethylbenzamide
CID 115745650
N-cyclobutyl-4-fluoro-N,2-dimethylbenzamide
CID 115745905
2-amino-4-chloro-N-methyl-N-pyridin-4-ylbenzamide
CID 106934198
N,5-dimethyl-2-(methylamino)-N-pyridin-4-ylbenzamide
CID 106937153
2-bromo-4-fluoro-N-methyl-N-phenylbenzamide
CID 24710295

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-N,2-dimethyl-N-pyridin-4-ylbenzamide?
The IUPAC name of 4-fluoro-N,2-dimethyl-N-pyridin-4-ylbenzamide (CID 106934866) is 4-fluoro-N,2-dimethyl-N-pyridin-4-ylbenzamide.
What is the SMILES notation for 4-fluoro-N,2-dimethyl-N-pyridin-4-ylbenzamide?
The canonical SMILES for 4-fluoro-N,2-dimethyl-N-pyridin-4-ylbenzamide is Cc1cc(F)ccc1C(=O)N(C)c1ccncc1.
What is the InChIKey of 4-fluoro-N,2-dimethyl-N-pyridin-4-ylbenzamide?
The InChIKey is JZWBIUIWQWMQJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13FN2O/c1-10-9-11(15)3-4-13(10)14(18)17(2)12-5-7-16-8-6-12/h3-9H,1-2H3.
What are the key properties of 4-fluoro-N,2-dimethyl-N-pyridin-4-ylbenzamide?
4-fluoro-N,2-dimethyl-N-pyridin-4-ylbenzamide has a molecular weight of 244.27 g/mol, XLogP of 2.81, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-N,2-dimethyl-N-pyridin-4-ylbenzamide is sourced from PubChem (CID 106934866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).