2-fluoro-N,4-dimethyl-N-piperidin-4-ylbenzamide;hydrochloride

C14H20ClFN2O — CID 119443710

IUPAC2-fluoro-N,4-dimethyl-N-piperidin-4-ylbenzamide;hydrochloride
SMILESCc1ccc(C(=O)N(C)C2CCNCC2)c(F)c1.Cl
InChIInChI=1S/C14H19FN2O.ClH/c1-10-3-4-12(13(15)9-10)14(18)17(2)11-5-7-16-8-6-11;/h3-4,9,11,16H,5-8H2,1-2H3;1H
InChIKeyPHRNKBWMTNDTEN-UHFFFAOYSA-N
MW286.78 g/mol
LogP2.38
Rot. Bonds2

About 2-fluoro-N,4-dimethyl-N-piperidin-4-ylbenzamide;hydrochloride

2-fluoro-N,4-dimethyl-N-piperidin-4-ylbenzamide;hydrochloride (PubChem CID 119443710) has the molecular formula C14H20ClFN2O and a molecular weight of 286.78 g/mol. Its IUPAC name is 2-fluoro-N,4-dimethyl-N-piperidin-4-ylbenzamide;hydrochloride.

Molecular Properties

Compound Name2-fluoro-N,4-dimethyl-N-piperidin-4-ylbenzamide;hydrochloride
PubChem CID119443710
Molecular FormulaC14H20ClFN2O
Molecular Weight286.78 g/mol
Exact Mass286.12
IUPAC Name2-fluoro-N,4-dimethyl-N-piperidin-4-ylbenzamide;hydrochloride
SMILESCc1ccc(C(=O)N(C)C2CCNCC2)c(F)c1.Cl
InChIInChI=1S/C14H19FN2O.ClH/c1-10-3-4-12(13(15)9-10)14(18)17(2)11-5-7-16-8-6-11;/h3-4,9,11,16H,5-8H2,1-2H3;1H
InChIKeyPHRNKBWMTNDTEN-UHFFFAOYSA-N
XLogP2.38
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.78
LogP ≤ 52.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-fluoro-N,4-dimethyl-N-piperidin-4-ylbenzamide;hydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2,4-difluoro-N-methyl-N-piperidin-4-ylbenzamide;hydrochloride
CID 119443342
2,3,4-trifluoro-N-methyl-N-piperidin-4-ylbenzamide
CID 79750025
2,4-dichloro-N-methyl-N-piperidin-4-ylbenzamide;hydrochloride
CID 119444290
2,3-difluoro-N-methyl-N-piperidin-4-ylbenzamide;hydrochloride
CID 119444296
N-cyclohexyl-2-fluoro-N,5-dimethylbenzamide
CID 62510377
N-(azepan-4-yl)-2-fluoro-N-methyl-4-nitrobenzamide
CID 104974655
2-fluoro-N-methyl-N-piperidin-4-yl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzamide
CID 176731051
2-bromo-5-fluoro-N-methyl-N-piperidin-4-ylbenzamide;hydrochloride
CID 119444450
2-chloro-4,5-difluoro-N-methyl-N-piperidin-4-ylbenzamide
CID 119443353
2-fluoro-4-methyl-N-piperidin-4-ylbenzamide;hydrochloride
CID 119389290
N-cyclopropyl-2-fluoro-4-hydroxy-N-methylbenzamide
CID 103940160
2,4,6-trifluoro-N-methyl-N-piperidin-4-ylbenzamide
CID 65100676

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-N,4-dimethyl-N-piperidin-4-ylbenzamide;hydrochloride?
The IUPAC name of 2-fluoro-N,4-dimethyl-N-piperidin-4-ylbenzamide;hydrochloride (CID 119443710) is 2-fluoro-N,4-dimethyl-N-piperidin-4-ylbenzamide;hydrochloride.
What is the SMILES notation for 2-fluoro-N,4-dimethyl-N-piperidin-4-ylbenzamide;hydrochloride?
The canonical SMILES for 2-fluoro-N,4-dimethyl-N-piperidin-4-ylbenzamide;hydrochloride is Cc1ccc(C(=O)N(C)C2CCNCC2)c(F)c1.Cl.
What is the InChIKey of 2-fluoro-N,4-dimethyl-N-piperidin-4-ylbenzamide;hydrochloride?
The InChIKey is PHRNKBWMTNDTEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19FN2O.ClH/c1-10-3-4-12(13(15)9-10)14(18)17(2)11-5-7-16-8-6-11;/h3-4,9,11,16H,5-8H2,1-2H3;1H.
What are the key properties of 2-fluoro-N,4-dimethyl-N-piperidin-4-ylbenzamide;hydrochloride?
2-fluoro-N,4-dimethyl-N-piperidin-4-ylbenzamide;hydrochloride has a molecular weight of 286.78 g/mol, XLogP of 2.38, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N,4-dimethyl-N-piperidin-4-ylbenzamide;hydrochloride is sourced from PubChem (CID 119443710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).