N-[1-(2-chloro-6-fluorobenzoyl)piperidin-4-yl]-3,5-dihydroxybenzamide

C19H18ClFN2O4 — CID 108558235

IUPACN-[1-(2-chloro-6-fluorobenzoyl)piperidin-4-yl]-3,5-dihydroxybenzamide
SMILESO=C(NC1CCN(C(=O)c2c(F)cccc2Cl)CC1)c1cc(O)cc(O)c1
InChIInChI=1S/C19H18ClFN2O4/c20-15-2-1-3-16(21)17(15)19(27)23-6-4-12(5-7-23)22-18(26)11-8-13(24)10-14(25)9-11/h1-3,8-10,12,24-25H,4-7H2,(H,22,26)
InChIKeyUSKCONKJXPIFPZ-UHFFFAOYSA-N
MW392.81 g/mol
LogP2.92
Rot. Bonds3

About N-[1-(2-chloro-6-fluorobenzoyl)piperidin-4-yl]-3,5-dihydroxybenzamide

N-[1-(2-chloro-6-fluorobenzoyl)piperidin-4-yl]-3,5-dihydroxybenzamide (PubChem CID 108558235) has the molecular formula C19H18ClFN2O4 and a molecular weight of 392.81 g/mol. Its IUPAC name is N-[1-(2-chloro-6-fluorobenzoyl)piperidin-4-yl]-3,5-dihydroxybenzamide.

Molecular Properties

Compound NameN-[1-(2-chloro-6-fluorobenzoyl)piperidin-4-yl]-3,5-dihydroxybenzamide
PubChem CID108558235
Molecular FormulaC19H18ClFN2O4
Molecular Weight392.81 g/mol
Exact Mass392.09
IUPAC NameN-[1-(2-chloro-6-fluorobenzoyl)piperidin-4-yl]-3,5-dihydroxybenzamide
SMILESO=C(NC1CCN(C(=O)c2c(F)cccc2Cl)CC1)c1cc(O)cc(O)c1
InChIInChI=1S/C19H18ClFN2O4/c20-15-2-1-3-16(21)17(15)19(27)23-6-4-12(5-7-23)22-18(26)11-8-13(24)10-14(25)9-11/h1-3,8-10,12,24-25H,4-7H2,(H,22,26)
InChIKeyUSKCONKJXPIFPZ-UHFFFAOYSA-N
XLogP2.92
TPSA89.87 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.81
LogP ≤ 52.92
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-chloro-N-[1-(2-chloro-6-fluorobenzoyl)piperidin-4-yl]benzamide
CID 108550866
N-[1-(2-chloro-6-fluorobenzoyl)piperidin-4-yl]-2,4-difluorobenzamide
CID 108567325
2-chloro-6-fluoro-N-[1-(3-fluorobenzoyl)piperidin-4-yl]benzamide
CID 108558699
2,2-dichloro-N-[1-(2-chloro-6-fluorobenzoyl)piperidin-4-yl]acetamide
CID 108567322
N-[1-(2-chloro-6-fluorobenzoyl)piperidin-4-yl]propanamide
CID 110821572
2-chloro-N-[1-(2-chloro-6-fluorobenzoyl)piperidin-4-yl]propanamide
CID 108567332
N-[1-(3,4-dichlorobenzoyl)piperidin-4-yl]-3,5-dihydroxybenzamide
CID 108558128
N-[1-(3,5-dihydroxybenzoyl)piperidin-4-yl]-2-fluorobenzamide
CID 108549393
[4-(2-chloro-6-fluorobenzoyl)piperazin-1-yl]-(3-hydroxyphenyl)methanone
CID 108537079
N-[1-(2,4-difluorobenzoyl)piperidin-4-yl]-3,5-dihydroxybenzamide
CID 108562910
1-(2-chloro-6-fluorobenzoyl)-N-cyclohexylpiperidine-4-carboxamide
CID 113003080
N-[1-(3-bromobenzoyl)piperidin-4-yl]-3,5-dihydroxybenzamide
CID 108558150

Frequently Asked Questions

What is the IUPAC name of N-[1-(2-chloro-6-fluorobenzoyl)piperidin-4-yl]-3,5-dihydroxybenzamide?
The IUPAC name of N-[1-(2-chloro-6-fluorobenzoyl)piperidin-4-yl]-3,5-dihydroxybenzamide (CID 108558235) is N-[1-(2-chloro-6-fluorobenzoyl)piperidin-4-yl]-3,5-dihydroxybenzamide.
What is the SMILES notation for N-[1-(2-chloro-6-fluorobenzoyl)piperidin-4-yl]-3,5-dihydroxybenzamide?
The canonical SMILES for N-[1-(2-chloro-6-fluorobenzoyl)piperidin-4-yl]-3,5-dihydroxybenzamide is O=C(NC1CCN(C(=O)c2c(F)cccc2Cl)CC1)c1cc(O)cc(O)c1.
What is the InChIKey of N-[1-(2-chloro-6-fluorobenzoyl)piperidin-4-yl]-3,5-dihydroxybenzamide?
The InChIKey is USKCONKJXPIFPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18ClFN2O4/c20-15-2-1-3-16(21)17(15)19(27)23-6-4-12(5-7-23)22-18(26)11-8-13(24)10-14(25)9-11/h1-3,8-10,12,24-25H,4-7H2,(H,22,26).
What are the key properties of N-[1-(2-chloro-6-fluorobenzoyl)piperidin-4-yl]-3,5-dihydroxybenzamide?
N-[1-(2-chloro-6-fluorobenzoyl)piperidin-4-yl]-3,5-dihydroxybenzamide has a molecular weight of 392.81 g/mol, XLogP of 2.92, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2-chloro-6-fluorobenzoyl)piperidin-4-yl]-3,5-dihydroxybenzamide is sourced from PubChem (CID 108558235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).