4-fluoro-N-[1-(4-fluorobenzoyl)piperidin-3-yl]benzamide

C19H18F2N2O2 — CID 11450767

IUPAC4-fluoro-N-[1-(4-fluorobenzoyl)piperidin-3-yl]benzamide
SMILESO=C(NC1CCCN(C(=O)c2ccc(F)cc2)C1)c1ccc(F)cc1
InChIInChI=1S/C19H18F2N2O2/c20-15-7-3-13(4-8-15)18(24)22-17-2-1-11-23(12-17)19(25)14-5-9-16(21)10-6-14/h3-10,17H,1-2,11-12H2,(H,22,24)
InChIKeyDYVXXAVLXOCCJD-UHFFFAOYSA-N
MW344.36 g/mol
LogP3.00
Rot. Bonds3

About 4-fluoro-N-[1-(4-fluorobenzoyl)piperidin-3-yl]benzamide

4-fluoro-N-[1-(4-fluorobenzoyl)piperidin-3-yl]benzamide (PubChem CID 11450767) has the molecular formula C19H18F2N2O2 and a molecular weight of 344.36 g/mol. Its IUPAC name is 4-fluoro-N-[1-(4-fluorobenzoyl)piperidin-3-yl]benzamide.

Molecular Properties

Compound Name4-fluoro-N-[1-(4-fluorobenzoyl)piperidin-3-yl]benzamide
PubChem CID11450767
Molecular FormulaC19H18F2N2O2
Molecular Weight344.36 g/mol
Exact Mass344.13
IUPAC Name4-fluoro-N-[1-(4-fluorobenzoyl)piperidin-3-yl]benzamide
SMILESO=C(NC1CCCN(C(=O)c2ccc(F)cc2)C1)c1ccc(F)cc1
InChIInChI=1S/C19H18F2N2O2/c20-15-7-3-13(4-8-15)18(24)22-17-2-1-11-23(12-17)19(25)14-5-9-16(21)10-6-14/h3-10,17H,1-2,11-12H2,(H,22,24)
InChIKeyDYVXXAVLXOCCJD-UHFFFAOYSA-N
XLogP3.00
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.36
LogP ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(4-fluorophenyl)-[3-(methylamino)piperidin-1-yl]methanone
CID 62535610
(4-fluorophenyl)-[(3S)-3-(methylamino)piperidin-1-yl]methanone;hydrochloride
CID 172646152
N-[(3R)-1-benzoylpiperidin-3-yl]-3,5-difluorobenzamide
CID 95276175
N-[(3S)-1-benzoylpiperidin-3-yl]-3,5-difluorobenzamide
CID 95276174
N-[(3R)-1-(4-methylbenzoyl)piperidin-3-yl]benzamide
CID 59294620
4-chloro-N-[1-(4-methylbenzoyl)piperidin-3-yl]benzamide
CID 68593380
(3R)-N-cyclopentyl-1-(4-fluorobenzoyl)piperidine-3-carboxamide
CID 25392682
N-(1-acetylpyrrolidin-3-yl)-4-fluorobenzamide
CID 110871339
N-[(3S)-1-(4-fluorobenzoyl)pyrrolidin-3-yl]cyclobutanecarboxamide
CID 95051653
(4-fluorophenyl)-(3-methylpiperidin-1-yl)methanone
CID 3113489
N-cyclopropyl-4-(pyrrolidine-1-carbonyl)benzamide
CID 109043261
[(3S)-3-(4-fluoroanilino)piperidin-1-yl]-phenylmethanone
CID 25449307

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-N-[1-(4-fluorobenzoyl)piperidin-3-yl]benzamide?
The IUPAC name of 4-fluoro-N-[1-(4-fluorobenzoyl)piperidin-3-yl]benzamide (CID 11450767) is 4-fluoro-N-[1-(4-fluorobenzoyl)piperidin-3-yl]benzamide.
What is the SMILES notation for 4-fluoro-N-[1-(4-fluorobenzoyl)piperidin-3-yl]benzamide?
The canonical SMILES for 4-fluoro-N-[1-(4-fluorobenzoyl)piperidin-3-yl]benzamide is O=C(NC1CCCN(C(=O)c2ccc(F)cc2)C1)c1ccc(F)cc1.
What is the InChIKey of 4-fluoro-N-[1-(4-fluorobenzoyl)piperidin-3-yl]benzamide?
The InChIKey is DYVXXAVLXOCCJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18F2N2O2/c20-15-7-3-13(4-8-15)18(24)22-17-2-1-11-23(12-17)19(25)14-5-9-16(21)10-6-14/h3-10,17H,1-2,11-12H2,(H,22,24).
What are the key properties of 4-fluoro-N-[1-(4-fluorobenzoyl)piperidin-3-yl]benzamide?
4-fluoro-N-[1-(4-fluorobenzoyl)piperidin-3-yl]benzamide has a molecular weight of 344.36 g/mol, XLogP of 3.00, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-N-[1-(4-fluorobenzoyl)piperidin-3-yl]benzamide is sourced from PubChem (CID 11450767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).