N-(2,3-dichlorophenyl)-1-(4-fluorobenzoyl)piperidine-4-carboxamide

C19H17Cl2FN2O2 — CID 1327552

IUPACN-(2,3-dichlorophenyl)-1-(4-fluorobenzoyl)piperidine-4-carboxamide
SMILESO=C(Nc1cccc(Cl)c1Cl)C1CCN(C(=O)c2ccc(F)cc2)CC1
InChIInChI=1S/C19H17Cl2FN2O2/c20-15-2-1-3-16(17(15)21)23-18(25)12-8-10-24(11-9-12)19(26)13-4-6-14(22)7-5-13/h1-7,12H,8-11H2,(H,23,25)
InChIKeyVEDIKQVBPVKGOQ-UHFFFAOYSA-N
MW395.26 g/mol
LogP4.62
Rot. Bonds3

About N-(2,3-dichlorophenyl)-1-(4-fluorobenzoyl)piperidine-4-carboxamide

N-(2,3-dichlorophenyl)-1-(4-fluorobenzoyl)piperidine-4-carboxamide (PubChem CID 1327552) has the molecular formula C19H17Cl2FN2O2 and a molecular weight of 395.26 g/mol. Its IUPAC name is N-(2,3-dichlorophenyl)-1-(4-fluorobenzoyl)piperidine-4-carboxamide.

Molecular Properties

Compound NameN-(2,3-dichlorophenyl)-1-(4-fluorobenzoyl)piperidine-4-carboxamide
PubChem CID1327552
Molecular FormulaC19H17Cl2FN2O2
Molecular Weight395.26 g/mol
Exact Mass394.07
IUPAC NameN-(2,3-dichlorophenyl)-1-(4-fluorobenzoyl)piperidine-4-carboxamide
SMILESO=C(Nc1cccc(Cl)c1Cl)C1CCN(C(=O)c2ccc(F)cc2)CC1
InChIInChI=1S/C19H17Cl2FN2O2/c20-15-2-1-3-16(17(15)21)23-18(25)12-8-10-24(11-9-12)19(26)13-4-6-14(22)7-5-13/h1-7,12H,8-11H2,(H,23,25)
InChIKeyVEDIKQVBPVKGOQ-UHFFFAOYSA-N
XLogP4.62
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500395.26
LogP ≤ 54.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[3-chloro-2-(dimethylamino)phenyl]-1-(4-fluorobenzoyl)piperidine-4-carboxamide
CID 55700862
N-(4-chloro-2-fluorophenyl)-1-(4-fluorobenzoyl)piperidine-4-carboxamide
CID 7961244
1-(4-fluorobenzoyl)-N-[2-(methylcarbamoyl)phenyl]piperidine-4-carboxamide
CID 51218219
N-[3-(cyclopropanecarbonylamino)phenyl]-1-(4-fluorobenzoyl)piperidine-4-carboxamide
CID 38324789
1-(4-fluorobenzoyl)-N-(2-propan-2-ylphenyl)piperidine-4-carboxamide
CID 17223875
1-(4-fluorobenzoyl)-N-quinolin-8-ylpiperidine-4-carboxamide
CID 26123213
N-(2,3-dichlorophenyl)cyclopropanecarboxamide
CID 4652086
1-(4-fluorobenzoyl)-N-(2-methyl-3-nitrophenyl)piperidine-4-carboxamide
CID 17223933
N-(2-benzoyl-4-chlorophenyl)-1-(4-fluorobenzoyl)piperidine-4-carboxamide
CID 17223887
N-(4-chloro-2-methoxy-5-methylphenyl)-1-(4-fluorobenzoyl)piperidine-4-carboxamide
CID 35106489
N-(2-chlorophenyl)-1-(4-fluorobenzoyl)piperidine-3-carboxamide
CID 51272015
N-(2-cyclopentylsulfanylphenyl)-1-(4-fluorobenzoyl)piperidine-4-carboxamide
CID 32559066

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dichlorophenyl)-1-(4-fluorobenzoyl)piperidine-4-carboxamide?
The IUPAC name of N-(2,3-dichlorophenyl)-1-(4-fluorobenzoyl)piperidine-4-carboxamide (CID 1327552) is N-(2,3-dichlorophenyl)-1-(4-fluorobenzoyl)piperidine-4-carboxamide.
What is the SMILES notation for N-(2,3-dichlorophenyl)-1-(4-fluorobenzoyl)piperidine-4-carboxamide?
The canonical SMILES for N-(2,3-dichlorophenyl)-1-(4-fluorobenzoyl)piperidine-4-carboxamide is O=C(Nc1cccc(Cl)c1Cl)C1CCN(C(=O)c2ccc(F)cc2)CC1.
What is the InChIKey of N-(2,3-dichlorophenyl)-1-(4-fluorobenzoyl)piperidine-4-carboxamide?
The InChIKey is VEDIKQVBPVKGOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17Cl2FN2O2/c20-15-2-1-3-16(17(15)21)23-18(25)12-8-10-24(11-9-12)19(26)13-4-6-14(22)7-5-13/h1-7,12H,8-11H2,(H,23,25).
What are the key properties of N-(2,3-dichlorophenyl)-1-(4-fluorobenzoyl)piperidine-4-carboxamide?
N-(2,3-dichlorophenyl)-1-(4-fluorobenzoyl)piperidine-4-carboxamide has a molecular weight of 395.26 g/mol, XLogP of 4.62, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dichlorophenyl)-1-(4-fluorobenzoyl)piperidine-4-carboxamide is sourced from PubChem (CID 1327552), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).