3,4-difluoro-N-methyl-N-(2-piperidin-2-ylethyl)benzamide

C15H20F2N2O — CID 43187173

IUPAC3,4-difluoro-N-methyl-N-(2-piperidin-2-ylethyl)benzamide
SMILESCN(CCC1CCCCN1)C(=O)c1ccc(F)c(F)c1
InChIInChI=1S/C15H20F2N2O/c1-19(9-7-12-4-2-3-8-18-12)15(20)11-5-6-13(16)14(17)10-11/h5-6,10,12,18H,2-4,7-9H2,1H3
InChIKeyIOGBJUKAEJPGKW-UHFFFAOYSA-N
MW282.33 g/mol
LogP2.57
Rot. Bonds4

About 3,4-difluoro-N-methyl-N-(2-piperidin-2-ylethyl)benzamide

3,4-difluoro-N-methyl-N-(2-piperidin-2-ylethyl)benzamide (PubChem CID 43187173) has the molecular formula C15H20F2N2O and a molecular weight of 282.33 g/mol. Its IUPAC name is 3,4-difluoro-N-methyl-N-(2-piperidin-2-ylethyl)benzamide.

Molecular Properties

Compound Name3,4-difluoro-N-methyl-N-(2-piperidin-2-ylethyl)benzamide
PubChem CID43187173
Molecular FormulaC15H20F2N2O
Molecular Weight282.33 g/mol
Exact Mass282.15
IUPAC Name3,4-difluoro-N-methyl-N-(2-piperidin-2-ylethyl)benzamide
SMILESCN(CCC1CCCCN1)C(=O)c1ccc(F)c(F)c1
InChIInChI=1S/C15H20F2N2O/c1-19(9-7-12-4-2-3-8-18-12)15(20)11-5-6-13(16)14(17)10-11/h5-6,10,12,18H,2-4,7-9H2,1H3
InChIKeyIOGBJUKAEJPGKW-UHFFFAOYSA-N
XLogP2.57
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.33
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-hydroxy-4-methoxy-N-methyl-N-(2-piperidin-2-ylethyl)benzamide
CID 79737443
3-methoxy-N,4-dimethyl-N-(2-piperidin-2-ylethyl)benzamide
CID 43187175
3-bromo-4-fluoro-N-methyl-N-(piperidin-2-ylmethyl)benzamide
CID 107956374
3,4-difluoro-N-propyl-N-(pyrrolidin-2-ylmethyl)benzamide
CID 106610422
2-(3-fluorophenyl)-N-methyl-N-(2-piperidin-2-ylethyl)acetamide
CID 43187167
3-(2-fluorophenyl)-1-methyl-1-(2-piperidin-2-ylethyl)urea
CID 43187196
3,4,5-trifluoro-N-methyl-N-(pyrrolidin-2-ylmethyl)benzamide
CID 106607828
4-fluoro-3-methyl-N-(piperidin-2-ylmethyl)-N-propylbenzamide
CID 106625701
N-methyl-2-phenyl-N-(2-piperidin-2-ylethyl)acetamide
CID 43187176
N-methyl-N-(piperidin-2-ylmethyl)-2,3-dihydro-1H-indene-5-carboxamide
CID 106627264
N,2,5-trimethyl-N-(2-piperidin-2-ylethyl)pyrazole-3-carboxamide
CID 66126689
3-benzyl-1-methyl-1-(2-piperidin-2-ylethyl)urea
CID 107653392

Frequently Asked Questions

What is the IUPAC name of 3,4-difluoro-N-methyl-N-(2-piperidin-2-ylethyl)benzamide?
The IUPAC name of 3,4-difluoro-N-methyl-N-(2-piperidin-2-ylethyl)benzamide (CID 43187173) is 3,4-difluoro-N-methyl-N-(2-piperidin-2-ylethyl)benzamide.
What is the SMILES notation for 3,4-difluoro-N-methyl-N-(2-piperidin-2-ylethyl)benzamide?
The canonical SMILES for 3,4-difluoro-N-methyl-N-(2-piperidin-2-ylethyl)benzamide is CN(CCC1CCCCN1)C(=O)c1ccc(F)c(F)c1.
What is the InChIKey of 3,4-difluoro-N-methyl-N-(2-piperidin-2-ylethyl)benzamide?
The InChIKey is IOGBJUKAEJPGKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20F2N2O/c1-19(9-7-12-4-2-3-8-18-12)15(20)11-5-6-13(16)14(17)10-11/h5-6,10,12,18H,2-4,7-9H2,1H3.
What are the key properties of 3,4-difluoro-N-methyl-N-(2-piperidin-2-ylethyl)benzamide?
3,4-difluoro-N-methyl-N-(2-piperidin-2-ylethyl)benzamide has a molecular weight of 282.33 g/mol, XLogP of 2.57, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-difluoro-N-methyl-N-(2-piperidin-2-ylethyl)benzamide is sourced from PubChem (CID 43187173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).