4-fluoro-N-methyl-N-(2-piperidin-4-ylethyl)benzamide

C15H21FN2O — CID 54945330

IUPAC4-fluoro-N-methyl-N-(2-piperidin-4-ylethyl)benzamide
SMILESCN(CCC1CCNCC1)C(=O)c1ccc(F)cc1
InChIInChI=1S/C15H21FN2O/c1-18(11-8-12-6-9-17-10-7-12)15(19)13-2-4-14(16)5-3-13/h2-5,12,17H,6-11H2,1H3
InChIKeyROQRBEPLZGBZEW-UHFFFAOYSA-N
MW264.34 g/mol
LogP2.29
Rot. Bonds4

About 4-fluoro-N-methyl-N-(2-piperidin-4-ylethyl)benzamide

4-fluoro-N-methyl-N-(2-piperidin-4-ylethyl)benzamide (PubChem CID 54945330) has the molecular formula C15H21FN2O and a molecular weight of 264.34 g/mol. Its IUPAC name is 4-fluoro-N-methyl-N-(2-piperidin-4-ylethyl)benzamide.

Molecular Properties

Compound Name4-fluoro-N-methyl-N-(2-piperidin-4-ylethyl)benzamide
PubChem CID54945330
Molecular FormulaC15H21FN2O
Molecular Weight264.34 g/mol
Exact Mass264.16
IUPAC Name4-fluoro-N-methyl-N-(2-piperidin-4-ylethyl)benzamide
SMILESCN(CCC1CCNCC1)C(=O)c1ccc(F)cc1
InChIInChI=1S/C15H21FN2O/c1-18(11-8-12-6-9-17-10-7-12)15(19)13-2-4-14(16)5-3-13/h2-5,12,17H,6-11H2,1H3
InChIKeyROQRBEPLZGBZEW-UHFFFAOYSA-N
XLogP2.29
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.34
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-ethyl-N-methyl-N-(2-piperidin-4-ylethyl)benzamide
CID 60915091
3-(4-fluorophenyl)-1-methyl-1-(2-piperidin-4-ylethyl)urea
CID 60913033
ethane;N-methyl-N-(4-piperidin-4-ylbutyl)benzamide
CID 142036974
2-fluoro-6-hydroxy-N-methyl-N-(2-piperidin-4-ylethyl)benzamide
CID 107014722
3-methoxy-N,4-dimethyl-N-(2-piperidin-4-ylethyl)benzamide
CID 60914907
4-amino-N-(2-cyclobutylethyl)-N-methylbenzamide
CID 115161061
methyl(2-piperidin-4-ylethyl)carbamic acid
CID 69061019
4-fluoro-N-methyl-N-propylbenzamide
CID 60928889
1-methyl-3-phenyl-1-(2-piperidin-4-ylethyl)urea
CID 54945242
4-fluoro-N-methyl-N-[(1-methylpiperidin-4-yl)methyl]benzamide
CID 63236434
2,4-difluoro-N-methyl-N-(piperidin-4-ylmethyl)benzamide
CID 79715450
4-[2-(4-fluorophenyl)ethyl]piperidine;2,2,2-trifluoroacetic acid
CID 134366951

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-N-methyl-N-(2-piperidin-4-ylethyl)benzamide?
The IUPAC name of 4-fluoro-N-methyl-N-(2-piperidin-4-ylethyl)benzamide (CID 54945330) is 4-fluoro-N-methyl-N-(2-piperidin-4-ylethyl)benzamide.
What is the SMILES notation for 4-fluoro-N-methyl-N-(2-piperidin-4-ylethyl)benzamide?
The canonical SMILES for 4-fluoro-N-methyl-N-(2-piperidin-4-ylethyl)benzamide is CN(CCC1CCNCC1)C(=O)c1ccc(F)cc1.
What is the InChIKey of 4-fluoro-N-methyl-N-(2-piperidin-4-ylethyl)benzamide?
The InChIKey is ROQRBEPLZGBZEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21FN2O/c1-18(11-8-12-6-9-17-10-7-12)15(19)13-2-4-14(16)5-3-13/h2-5,12,17H,6-11H2,1H3.
What are the key properties of 4-fluoro-N-methyl-N-(2-piperidin-4-ylethyl)benzamide?
4-fluoro-N-methyl-N-(2-piperidin-4-ylethyl)benzamide has a molecular weight of 264.34 g/mol, XLogP of 2.29, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-N-methyl-N-(2-piperidin-4-ylethyl)benzamide is sourced from PubChem (CID 54945330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).