N-[1-(2-chloro-6-fluorobenzoyl)piperidin-4-yl]-2,4-difluorobenzamide

C19H16ClF3N2O2 — CID 108567325

IUPACN-[1-(2-chloro-6-fluorobenzoyl)piperidin-4-yl]-2,4-difluorobenzamide
SMILESO=C(NC1CCN(C(=O)c2c(F)cccc2Cl)CC1)c1ccc(F)cc1F
InChIInChI=1S/C19H16ClF3N2O2/c20-14-2-1-3-15(22)17(14)19(27)25-8-6-12(7-9-25)24-18(26)13-5-4-11(21)10-16(13)23/h1-5,10,12H,6-9H2,(H,24,26)
InChIKeyIJFIDGTWFIDXPM-UHFFFAOYSA-N
MW396.80 g/mol
LogP3.79
Rot. Bonds3

About N-[1-(2-chloro-6-fluorobenzoyl)piperidin-4-yl]-2,4-difluorobenzamide

N-[1-(2-chloro-6-fluorobenzoyl)piperidin-4-yl]-2,4-difluorobenzamide (PubChem CID 108567325) has the molecular formula C19H16ClF3N2O2 and a molecular weight of 396.80 g/mol. Its IUPAC name is N-[1-(2-chloro-6-fluorobenzoyl)piperidin-4-yl]-2,4-difluorobenzamide.

Molecular Properties

Compound NameN-[1-(2-chloro-6-fluorobenzoyl)piperidin-4-yl]-2,4-difluorobenzamide
PubChem CID108567325
Molecular FormulaC19H16ClF3N2O2
Molecular Weight396.80 g/mol
Exact Mass396.09
IUPAC NameN-[1-(2-chloro-6-fluorobenzoyl)piperidin-4-yl]-2,4-difluorobenzamide
SMILESO=C(NC1CCN(C(=O)c2c(F)cccc2Cl)CC1)c1ccc(F)cc1F
InChIInChI=1S/C19H16ClF3N2O2/c20-14-2-1-3-15(22)17(14)19(27)25-8-6-12(7-9-25)24-18(26)13-5-4-11(21)10-16(13)23/h1-5,10,12H,6-9H2,(H,24,26)
InChIKeyIJFIDGTWFIDXPM-UHFFFAOYSA-N
XLogP3.79
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500396.80
LogP ≤ 53.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-chloro-N-[1-(2-chloro-6-fluorobenzoyl)piperidin-4-yl]benzamide
CID 108550866
2-chloro-6-fluoro-N-[1-(3-fluorobenzoyl)piperidin-4-yl]benzamide
CID 108558699
N-[1-(2-chloro-6-fluorobenzoyl)piperidin-4-yl]-3,5-dihydroxybenzamide
CID 108558235
2,2-dichloro-N-[1-(2-chloro-6-fluorobenzoyl)piperidin-4-yl]acetamide
CID 108567322
3-chloro-N-[1-(2,4-difluorobenzoyl)piperidin-4-yl]benzamide
CID 108559879
N-[1-(2-chloro-6-fluorobenzoyl)piperidin-4-yl]propanamide
CID 110821572
2,4-difluoro-N-[1-(3,4,5-trihydroxybenzoyl)piperidin-4-yl]benzamide
CID 108564431
2-chloro-N-[1-(2-chloro-6-fluorobenzoyl)piperidin-4-yl]propanamide
CID 108567332
2-chloro-6-fluoro-N-[1-(2-methoxybenzoyl)piperidin-4-yl]benzamide
CID 108558620
1-(2-chloro-6-fluorobenzoyl)-N-cyclohexylpiperidine-4-carboxamide
CID 113003080
2-chloro-6-fluoro-N-[2-[4-[(2-fluorobenzoyl)amino]piperidin-1-yl]-2-oxoethyl]benzamide
CID 86898999
N-[1-(2,4-difluorobenzoyl)piperidin-4-yl]-3,5-dihydroxybenzamide
CID 108562910

Frequently Asked Questions

What is the IUPAC name of N-[1-(2-chloro-6-fluorobenzoyl)piperidin-4-yl]-2,4-difluorobenzamide?
The IUPAC name of N-[1-(2-chloro-6-fluorobenzoyl)piperidin-4-yl]-2,4-difluorobenzamide (CID 108567325) is N-[1-(2-chloro-6-fluorobenzoyl)piperidin-4-yl]-2,4-difluorobenzamide.
What is the SMILES notation for N-[1-(2-chloro-6-fluorobenzoyl)piperidin-4-yl]-2,4-difluorobenzamide?
The canonical SMILES for N-[1-(2-chloro-6-fluorobenzoyl)piperidin-4-yl]-2,4-difluorobenzamide is O=C(NC1CCN(C(=O)c2c(F)cccc2Cl)CC1)c1ccc(F)cc1F.
What is the InChIKey of N-[1-(2-chloro-6-fluorobenzoyl)piperidin-4-yl]-2,4-difluorobenzamide?
The InChIKey is IJFIDGTWFIDXPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16ClF3N2O2/c20-14-2-1-3-15(22)17(14)19(27)25-8-6-12(7-9-25)24-18(26)13-5-4-11(21)10-16(13)23/h1-5,10,12H,6-9H2,(H,24,26).
What are the key properties of N-[1-(2-chloro-6-fluorobenzoyl)piperidin-4-yl]-2,4-difluorobenzamide?
N-[1-(2-chloro-6-fluorobenzoyl)piperidin-4-yl]-2,4-difluorobenzamide has a molecular weight of 396.80 g/mol, XLogP of 3.79, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2-chloro-6-fluorobenzoyl)piperidin-4-yl]-2,4-difluorobenzamide is sourced from PubChem (CID 108567325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).