N-[3-(3,4-dichlorophenyl)piperidin-4-yl]-4-fluoro-N-methylbenzamide

C19H19Cl2FN2O — CID 68930464

IUPACN-[3-(3,4-dichlorophenyl)piperidin-4-yl]-4-fluoro-N-methylbenzamide
SMILESCN(C(=O)c1ccc(F)cc1)C1CCNCC1c1ccc(Cl)c(Cl)c1
InChIInChI=1S/C19H19Cl2FN2O/c1-24(19(25)12-2-5-14(22)6-3-12)18-8-9-23-11-15(18)13-4-7-16(20)17(21)10-13/h2-7,10,15,18,23H,8-9,11H2,1H3
InChIKeyQXZATWZRYUQTAL-UHFFFAOYSA-N
MW381.28 g/mol
LogP4.35
Rot. Bonds3

About N-[3-(3,4-dichlorophenyl)piperidin-4-yl]-4-fluoro-N-methylbenzamide

N-[3-(3,4-dichlorophenyl)piperidin-4-yl]-4-fluoro-N-methylbenzamide (PubChem CID 68930464) has the molecular formula C19H19Cl2FN2O and a molecular weight of 381.28 g/mol. Its IUPAC name is N-[3-(3,4-dichlorophenyl)piperidin-4-yl]-4-fluoro-N-methylbenzamide.

Molecular Properties

Compound NameN-[3-(3,4-dichlorophenyl)piperidin-4-yl]-4-fluoro-N-methylbenzamide
PubChem CID68930464
Molecular FormulaC19H19Cl2FN2O
Molecular Weight381.28 g/mol
Exact Mass380.09
IUPAC NameN-[3-(3,4-dichlorophenyl)piperidin-4-yl]-4-fluoro-N-methylbenzamide
SMILESCN(C(=O)c1ccc(F)cc1)C1CCNCC1c1ccc(Cl)c(Cl)c1
InChIInChI=1S/C19H19Cl2FN2O/c1-24(19(25)12-2-5-14(22)6-3-12)18-8-9-23-11-15(18)13-4-7-16(20)17(21)10-13/h2-7,10,15,18,23H,8-9,11H2,1H3
InChIKeyQXZATWZRYUQTAL-UHFFFAOYSA-N
XLogP4.35
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.28
LogP ≤ 54.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

Saredutant
CID 104974
U-47700
CID 71719125
Dnk 333
CID 9939040
2,3-Dichloro-N-[2-(4,4-difluoro-piperidin-1-yl)-2-(4-fluoro-phenyl)-ethyl]-benzamide
CID 73442861
N-(1-benzyl-4-piperidinyl)-2,4-dichlorobenzamide
CID 1069892
N-(1-(4-chlorophenyl)-3-(dimethylamino)propyl)-4-phenylbenzamide
CID 11663047
Benzamide derivative 11
CID 41306362
(2r)-2-Amino-3-(3-Chlorophenyl)-1-[4-(2,5-Difluorobenzoyl)piperazin-1-Yl]propan-1-One
CID 53249967
Benzamide derivative 8
CID 118607347
3,4-dichloro-N-[1-(2,4-dimethylphenyl)ethyl]benzamide
CID 2807080
N-[4-(4-acetamido-4-phenylpiperidin-1-yl)-2-(3,4-dichlorophenyl)butyl]-N-methylbenzamide
CID 9850582
2-[3,5-bis(trifluoromethyl)phenyl]-N-[2-(3,4-dichlorophenyl)-2-(4-piperidin-1-ylpiperidin-1-yl)ethyl]acetamide
CID 44358731

Frequently Asked Questions

What is the IUPAC name of N-[3-(3,4-dichlorophenyl)piperidin-4-yl]-4-fluoro-N-methylbenzamide?
The IUPAC name of N-[3-(3,4-dichlorophenyl)piperidin-4-yl]-4-fluoro-N-methylbenzamide (CID 68930464) is N-[3-(3,4-dichlorophenyl)piperidin-4-yl]-4-fluoro-N-methylbenzamide.
What is the SMILES notation for N-[3-(3,4-dichlorophenyl)piperidin-4-yl]-4-fluoro-N-methylbenzamide?
The canonical SMILES for N-[3-(3,4-dichlorophenyl)piperidin-4-yl]-4-fluoro-N-methylbenzamide is CN(C(=O)c1ccc(F)cc1)C1CCNCC1c1ccc(Cl)c(Cl)c1.
What is the InChIKey of N-[3-(3,4-dichlorophenyl)piperidin-4-yl]-4-fluoro-N-methylbenzamide?
The InChIKey is QXZATWZRYUQTAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19Cl2FN2O/c1-24(19(25)12-2-5-14(22)6-3-12)18-8-9-23-11-15(18)13-4-7-16(20)17(21)10-13/h2-7,10,15,18,23H,8-9,11H2,1H3.
What are the key properties of N-[3-(3,4-dichlorophenyl)piperidin-4-yl]-4-fluoro-N-methylbenzamide?
N-[3-(3,4-dichlorophenyl)piperidin-4-yl]-4-fluoro-N-methylbenzamide has a molecular weight of 381.28 g/mol, XLogP of 4.35, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(3,4-dichlorophenyl)piperidin-4-yl]-4-fluoro-N-methylbenzamide is sourced from PubChem (CID 68930464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).