N-[1-[2-(4-fluorophenyl)acetyl]piperidin-4-yl]-3,5-dihydroxybenzamide

C20H21FN2O4 — CID 108558137

IUPACN-[1-[2-(4-fluorophenyl)acetyl]piperidin-4-yl]-3,5-dihydroxybenzamide
SMILESO=C(NC1CCN(C(=O)Cc2ccc(F)cc2)CC1)c1cc(O)cc(O)c1
InChIInChI=1S/C20H21FN2O4/c21-15-3-1-13(2-4-15)9-19(26)23-7-5-16(6-8-23)22-20(27)14-10-17(24)12-18(25)11-14/h1-4,10-12,16,24-25H,5-9H2,(H,22,27)
InChIKeyGLRORTUASYRZMZ-UHFFFAOYSA-N
MW372.40 g/mol
LogP2.20
Rot. Bonds4

About N-[1-[2-(4-fluorophenyl)acetyl]piperidin-4-yl]-3,5-dihydroxybenzamide

N-[1-[2-(4-fluorophenyl)acetyl]piperidin-4-yl]-3,5-dihydroxybenzamide (PubChem CID 108558137) has the molecular formula C20H21FN2O4 and a molecular weight of 372.40 g/mol. Its IUPAC name is N-[1-[2-(4-fluorophenyl)acetyl]piperidin-4-yl]-3,5-dihydroxybenzamide.

Molecular Properties

Compound NameN-[1-[2-(4-fluorophenyl)acetyl]piperidin-4-yl]-3,5-dihydroxybenzamide
PubChem CID108558137
Molecular FormulaC20H21FN2O4
Molecular Weight372.40 g/mol
Exact Mass372.15
IUPAC NameN-[1-[2-(4-fluorophenyl)acetyl]piperidin-4-yl]-3,5-dihydroxybenzamide
SMILESO=C(NC1CCN(C(=O)Cc2ccc(F)cc2)CC1)c1cc(O)cc(O)c1
InChIInChI=1S/C20H21FN2O4/c21-15-3-1-13(2-4-15)9-19(26)23-7-5-16(6-8-23)22-20(27)14-10-17(24)12-18(25)11-14/h1-4,10-12,16,24-25H,5-9H2,(H,22,27)
InChIKeyGLRORTUASYRZMZ-UHFFFAOYSA-N
XLogP2.20
TPSA89.87 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.40
LogP ≤ 52.20
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-[1-[2-(4-fluorophenyl)acetyl]piperidin-4-yl]benzamide
CID 33308755
N-[1-[2-(4-chlorophenyl)acetyl]piperidin-4-yl]-2-(4-fluorophenyl)acetamide
CID 108559477
N-[1-(2,4-difluorobenzoyl)piperidin-4-yl]-3,5-dihydroxybenzamide
CID 108562910
N-[1-[2-(4-fluorophenyl)acetyl]piperidin-4-yl]cyclohexanecarboxamide
CID 51096411
N-[1-[2-(4-fluorophenyl)acetyl]piperidin-4-yl]-3-methylbutanamide
CID 110820768
N-[1-[2-(4-ethoxyphenyl)acetyl]piperidin-4-yl]-3,4,5-trihydroxybenzamide
CID 108551512
N-[1-[2-(4-ethoxyphenyl)acetyl]piperidin-4-yl]-3-fluorobenzamide
CID 108557500
N-[1-[2-(4-aminophenyl)acetyl]piperidin-4-yl]benzamide;hydrochloride
CID 91641898
2-(4-ethoxyphenyl)-N-[1-[2-(4-fluorophenyl)acetyl]piperidin-4-yl]acetamide
CID 108553901
N-[1-[3-(4-fluorophenyl)propanoyl]piperidin-4-yl]thiophene-3-carboxamide
CID 47071577
N-cyclopentyl-4-[2-(4-fluorophenyl)acetyl]-1,4-diazepane-1-carboxamide
CID 110811571
lithium 1-[2-(4-fluorophenyl)acetyl]piperidine-4-carboxylate
CID 21304004

Frequently Asked Questions

What is the IUPAC name of N-[1-[2-(4-fluorophenyl)acetyl]piperidin-4-yl]-3,5-dihydroxybenzamide?
The IUPAC name of N-[1-[2-(4-fluorophenyl)acetyl]piperidin-4-yl]-3,5-dihydroxybenzamide (CID 108558137) is N-[1-[2-(4-fluorophenyl)acetyl]piperidin-4-yl]-3,5-dihydroxybenzamide.
What is the SMILES notation for N-[1-[2-(4-fluorophenyl)acetyl]piperidin-4-yl]-3,5-dihydroxybenzamide?
The canonical SMILES for N-[1-[2-(4-fluorophenyl)acetyl]piperidin-4-yl]-3,5-dihydroxybenzamide is O=C(NC1CCN(C(=O)Cc2ccc(F)cc2)CC1)c1cc(O)cc(O)c1.
What is the InChIKey of N-[1-[2-(4-fluorophenyl)acetyl]piperidin-4-yl]-3,5-dihydroxybenzamide?
The InChIKey is GLRORTUASYRZMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21FN2O4/c21-15-3-1-13(2-4-15)9-19(26)23-7-5-16(6-8-23)22-20(27)14-10-17(24)12-18(25)11-14/h1-4,10-12,16,24-25H,5-9H2,(H,22,27).
What are the key properties of N-[1-[2-(4-fluorophenyl)acetyl]piperidin-4-yl]-3,5-dihydroxybenzamide?
N-[1-[2-(4-fluorophenyl)acetyl]piperidin-4-yl]-3,5-dihydroxybenzamide has a molecular weight of 372.40 g/mol, XLogP of 2.20, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[2-(4-fluorophenyl)acetyl]piperidin-4-yl]-3,5-dihydroxybenzamide is sourced from PubChem (CID 108558137), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).