4-fluoro-N-[1-(2-hydroxy-5-methylbenzoyl)piperidin-4-yl]benzamide

C20H21FN2O3 — CID 32507439

IUPAC4-fluoro-N-[1-(2-hydroxy-5-methylbenzoyl)piperidin-4-yl]benzamide
SMILESCc1ccc(O)c(C(=O)N2CCC(NC(=O)c3ccc(F)cc3)CC2)c1
InChIInChI=1S/C20H21FN2O3/c1-13-2-7-18(24)17(12-13)20(26)23-10-8-16(9-11-23)22-19(25)14-3-5-15(21)6-4-14/h2-7,12,16,24H,8-11H2,1H3,(H,22,25)
InChIKeyKRKNOURJWPBDBM-UHFFFAOYSA-N
MW356.40 g/mol
LogP2.87
Rot. Bonds3

About 4-fluoro-N-[1-(2-hydroxy-5-methylbenzoyl)piperidin-4-yl]benzamide

4-fluoro-N-[1-(2-hydroxy-5-methylbenzoyl)piperidin-4-yl]benzamide (PubChem CID 32507439) has the molecular formula C20H21FN2O3 and a molecular weight of 356.40 g/mol. Its IUPAC name is 4-fluoro-N-[1-(2-hydroxy-5-methylbenzoyl)piperidin-4-yl]benzamide.

Molecular Properties

Compound Name4-fluoro-N-[1-(2-hydroxy-5-methylbenzoyl)piperidin-4-yl]benzamide
PubChem CID32507439
Molecular FormulaC20H21FN2O3
Molecular Weight356.40 g/mol
Exact Mass356.15
IUPAC Name4-fluoro-N-[1-(2-hydroxy-5-methylbenzoyl)piperidin-4-yl]benzamide
SMILESCc1ccc(O)c(C(=O)N2CCC(NC(=O)c3ccc(F)cc3)CC2)c1
InChIInChI=1S/C20H21FN2O3/c1-13-2-7-18(24)17(12-13)20(26)23-10-8-16(9-11-23)22-19(25)14-3-5-15(21)6-4-14/h2-7,12,16,24H,8-11H2,1H3,(H,22,25)
InChIKeyKRKNOURJWPBDBM-UHFFFAOYSA-N
XLogP2.87
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.40
LogP ≤ 52.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(2,5-dimethylbenzoyl)piperidin-4-yl]-4-fluorobenzamide
CID 32508392
N-[1-[1-(4-fluorophenyl)-2,5-dimethylpyrrole-3-carbonyl]piperidin-4-yl]benzamide
CID 18268324
3,4,5-trihydroxy-N-[1-(4-methylbenzoyl)piperidin-4-yl]benzamide
CID 108551461
(4-chloropiperidin-1-yl)-(2-hydroxy-5-methylphenyl)methanone
CID 63390640
4-[(4-fluorobenzoyl)amino]-N-methylpiperidine-1-carboxamide
CID 47162435
4-[[1-(4-methylbenzoyl)piperidin-4-yl]carbamoyl]benzoic acid
CID 119183945
N-[1-(furan-2-carbonyl)piperidin-4-yl]-2-hydroxy-5-methylbenzamide
CID 134000252
N-(1-chloropiperidin-4-yl)-4-fluorobenzamide
CID 89224691
4-fluoro-N-[1-[1-(4-methylphenyl)-3-phenylpyrazole-4-carbonyl]piperidin-4-yl]benzamide
CID 46591840
4-fluoro-N-[1-(2-methylbutanoyl)piperidin-4-yl]benzamide
CID 46592883
N-[1-(4-methylbenzoyl)piperidin-4-yl]-4-(trifluoromethyl)benzamide
CID 108558531
N-[1-(2,4-difluorobenzoyl)piperidin-4-yl]-3,5-dihydroxybenzamide
CID 108562910

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-N-[1-(2-hydroxy-5-methylbenzoyl)piperidin-4-yl]benzamide?
The IUPAC name of 4-fluoro-N-[1-(2-hydroxy-5-methylbenzoyl)piperidin-4-yl]benzamide (CID 32507439) is 4-fluoro-N-[1-(2-hydroxy-5-methylbenzoyl)piperidin-4-yl]benzamide.
What is the SMILES notation for 4-fluoro-N-[1-(2-hydroxy-5-methylbenzoyl)piperidin-4-yl]benzamide?
The canonical SMILES for 4-fluoro-N-[1-(2-hydroxy-5-methylbenzoyl)piperidin-4-yl]benzamide is Cc1ccc(O)c(C(=O)N2CCC(NC(=O)c3ccc(F)cc3)CC2)c1.
What is the InChIKey of 4-fluoro-N-[1-(2-hydroxy-5-methylbenzoyl)piperidin-4-yl]benzamide?
The InChIKey is KRKNOURJWPBDBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21FN2O3/c1-13-2-7-18(24)17(12-13)20(26)23-10-8-16(9-11-23)22-19(25)14-3-5-15(21)6-4-14/h2-7,12,16,24H,8-11H2,1H3,(H,22,25).
What are the key properties of 4-fluoro-N-[1-(2-hydroxy-5-methylbenzoyl)piperidin-4-yl]benzamide?
4-fluoro-N-[1-(2-hydroxy-5-methylbenzoyl)piperidin-4-yl]benzamide has a molecular weight of 356.40 g/mol, XLogP of 2.87, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-N-[1-(2-hydroxy-5-methylbenzoyl)piperidin-4-yl]benzamide is sourced from PubChem (CID 32507439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).