2,6-difluoro-N,3-dimethyl-N-piperidin-4-ylbenzamide

C14H18F2N2O — CID 82816537

IUPAC2,6-difluoro-N,3-dimethyl-N-piperidin-4-ylbenzamide
SMILESCc1ccc(F)c(C(=O)N(C)C2CCNCC2)c1F
InChIInChI=1S/C14H18F2N2O/c1-9-3-4-11(15)12(13(9)16)14(19)18(2)10-5-7-17-8-6-10/h3-4,10,17H,5-8H2,1-2H3
InChIKeyVGADEPRETIHHFZ-UHFFFAOYSA-N
MW268.31 g/mol
LogP2.10
Rot. Bonds2

About 2,6-difluoro-N,3-dimethyl-N-piperidin-4-ylbenzamide

2,6-difluoro-N,3-dimethyl-N-piperidin-4-ylbenzamide (PubChem CID 82816537) has the molecular formula C14H18F2N2O and a molecular weight of 268.31 g/mol. Its IUPAC name is 2,6-difluoro-N,3-dimethyl-N-piperidin-4-ylbenzamide.

Molecular Properties

Compound Name2,6-difluoro-N,3-dimethyl-N-piperidin-4-ylbenzamide
PubChem CID82816537
Molecular FormulaC14H18F2N2O
Molecular Weight268.31 g/mol
Exact Mass268.14
IUPAC Name2,6-difluoro-N,3-dimethyl-N-piperidin-4-ylbenzamide
SMILESCc1ccc(F)c(C(=O)N(C)C2CCNCC2)c1F
InChIInChI=1S/C14H18F2N2O/c1-9-3-4-11(15)12(13(9)16)14(19)18(2)10-5-7-17-8-6-10/h3-4,10,17H,5-8H2,1-2H3
InChIKeyVGADEPRETIHHFZ-UHFFFAOYSA-N
XLogP2.10
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.31
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2,6-difluoro-N,3-dimethyl-N-pyrrolidin-3-ylbenzamide
CID 82815007
N-ethyl-2,6-difluoro-3-methyl-N-piperidin-4-ylbenzamide
CID 82816613
2,3,4-trifluoro-N-methyl-N-piperidin-4-ylbenzamide
CID 79750025
2,4,6-trifluoro-N-methyl-N-piperidin-4-ylbenzamide
CID 65100676
2,6-difluoro-N-(2-hydroxycyclohexyl)-N,3-dimethylbenzamide
CID 102634808
2,3-difluoro-N-methyl-N-piperidin-4-ylbenzamide;hydrochloride
CID 119444296
N-(azepan-4-yl)-2-fluoro-6-methoxy-N-methylbenzamide
CID 107172410
N-methyl-N-piperidin-4-yl-4-(3,4,5-trifluorophenyl)benzamide
CID 119444616
2-fluoro-N,4-dimethyl-N-piperidin-4-ylbenzamide;hydrochloride
CID 119443710
2,4-difluoro-N-methyl-N-piperidin-4-ylbenzamide;hydrochloride
CID 119443342
2,6-dimethoxy-N-methyl-N-piperidin-4-ylbenzamide
CID 43602191
2,3,4-trifluoro-N-methyl-N-pyrrolidin-3-ylbenzamide
CID 79749564

Frequently Asked Questions

What is the IUPAC name of 2,6-difluoro-N,3-dimethyl-N-piperidin-4-ylbenzamide?
The IUPAC name of 2,6-difluoro-N,3-dimethyl-N-piperidin-4-ylbenzamide (CID 82816537) is 2,6-difluoro-N,3-dimethyl-N-piperidin-4-ylbenzamide.
What is the SMILES notation for 2,6-difluoro-N,3-dimethyl-N-piperidin-4-ylbenzamide?
The canonical SMILES for 2,6-difluoro-N,3-dimethyl-N-piperidin-4-ylbenzamide is Cc1ccc(F)c(C(=O)N(C)C2CCNCC2)c1F.
What is the InChIKey of 2,6-difluoro-N,3-dimethyl-N-piperidin-4-ylbenzamide?
The InChIKey is VGADEPRETIHHFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18F2N2O/c1-9-3-4-11(15)12(13(9)16)14(19)18(2)10-5-7-17-8-6-10/h3-4,10,17H,5-8H2,1-2H3.
What are the key properties of 2,6-difluoro-N,3-dimethyl-N-piperidin-4-ylbenzamide?
2,6-difluoro-N,3-dimethyl-N-piperidin-4-ylbenzamide has a molecular weight of 268.31 g/mol, XLogP of 2.10, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-difluoro-N,3-dimethyl-N-piperidin-4-ylbenzamide is sourced from PubChem (CID 82816537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).