2-(2,5-dichlorophenyl)-6-fluoro-N-(piperidin-4-ylmethyl)benzamide

C19H19Cl2FN2O — CID 46891022

IUPAC2-(2,5-dichlorophenyl)-6-fluoro-N-(piperidin-4-ylmethyl)benzamide
SMILESO=C(NCC1CCNCC1)c1c(F)cccc1-c1cc(Cl)ccc1Cl
InChIInChI=1S/C19H19Cl2FN2O/c20-13-4-5-16(21)15(10-13)14-2-1-3-17(22)18(14)19(25)24-11-12-6-8-23-9-7-12/h1-5,10,12,23H,6-9,11H2,(H,24,25)
InChIKeyNAKZMBCUNDKEPL-UHFFFAOYSA-N
MW381.28 g/mol
LogP4.53
Rot. Bonds4

About 2-(2,5-dichlorophenyl)-6-fluoro-N-(piperidin-4-ylmethyl)benzamide

2-(2,5-dichlorophenyl)-6-fluoro-N-(piperidin-4-ylmethyl)benzamide (PubChem CID 46891022) has the molecular formula C19H19Cl2FN2O and a molecular weight of 381.28 g/mol. Its IUPAC name is 2-(2,5-dichlorophenyl)-6-fluoro-N-(piperidin-4-ylmethyl)benzamide.

Molecular Properties

Compound Name2-(2,5-dichlorophenyl)-6-fluoro-N-(piperidin-4-ylmethyl)benzamide
PubChem CID46891022
Molecular FormulaC19H19Cl2FN2O
Molecular Weight381.28 g/mol
Exact Mass380.09
IUPAC Name2-(2,5-dichlorophenyl)-6-fluoro-N-(piperidin-4-ylmethyl)benzamide
SMILESO=C(NCC1CCNCC1)c1c(F)cccc1-c1cc(Cl)ccc1Cl
InChIInChI=1S/C19H19Cl2FN2O/c20-13-4-5-16(21)15(10-13)14-2-1-3-17(22)18(14)19(25)24-11-12-6-8-23-9-7-12/h1-5,10,12,23H,6-9,11H2,(H,24,25)
InChIKeyNAKZMBCUNDKEPL-UHFFFAOYSA-N
XLogP4.53
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.28
LogP ≤ 54.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2,3-Dichloro-N-[2-(4,4-difluoro-piperidin-1-yl)-2-(4-fluoro-phenyl)-ethyl]-benzamide
CID 73442861
(2r)-2-Amino-3-(3-Chlorophenyl)-1-[4-(2,5-Difluorobenzoyl)piperazin-1-Yl]propan-1-One
CID 53249967
(4-Benzylpiperidin-1-yl)(3-chlorophenyl)methanone
CID 814705
(3-Chloro-4-fluorophenyl)-[4-fluoro-4-[(3-phenylpropylamino)methyl]piperidin-1-yl]methanone
CID 132256764
2-Chloro-N-(2-phenyl-propyl)-benzamide
CID 3116854
N-[2-(1-benzylpiperidin-4-yl)ethyl]-4-chlorobenzamide hydrochloride
CID 14783875
2-(3-chlorophenyl)-6-fluoro-N-[[(3R,4S)-3-methylpiperidin-4-yl]methyl]benzamide
CID 46871844
2,5-dichloro-N-(2,2,6,6-tetramethylpiperidin-4-yl)benzamide
CID 848393
2-chloro-N-(cyclohexylmethyl)-4-fluorobenzamide
CID 6470536
N-(1-benzylpiperidin-4-yl)-2-(2-chloro-6-fluorophenyl)acetamide
CID 17173959
2-(3-Chloro-phenyl)-N-[1-(4-fluoro-benzyl)-piperidin-4-yl]-acetamide
CID 9841846
3-chloro-N-[[3-[3-(piperazin-1-ylmethyl)phenyl]phenyl]methyl]benzamide
CID 11330061

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dichlorophenyl)-6-fluoro-N-(piperidin-4-ylmethyl)benzamide?
The IUPAC name of 2-(2,5-dichlorophenyl)-6-fluoro-N-(piperidin-4-ylmethyl)benzamide (CID 46891022) is 2-(2,5-dichlorophenyl)-6-fluoro-N-(piperidin-4-ylmethyl)benzamide.
What is the SMILES notation for 2-(2,5-dichlorophenyl)-6-fluoro-N-(piperidin-4-ylmethyl)benzamide?
The canonical SMILES for 2-(2,5-dichlorophenyl)-6-fluoro-N-(piperidin-4-ylmethyl)benzamide is O=C(NCC1CCNCC1)c1c(F)cccc1-c1cc(Cl)ccc1Cl.
What is the InChIKey of 2-(2,5-dichlorophenyl)-6-fluoro-N-(piperidin-4-ylmethyl)benzamide?
The InChIKey is NAKZMBCUNDKEPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19Cl2FN2O/c20-13-4-5-16(21)15(10-13)14-2-1-3-17(22)18(14)19(25)24-11-12-6-8-23-9-7-12/h1-5,10,12,23H,6-9,11H2,(H,24,25).
What are the key properties of 2-(2,5-dichlorophenyl)-6-fluoro-N-(piperidin-4-ylmethyl)benzamide?
2-(2,5-dichlorophenyl)-6-fluoro-N-(piperidin-4-ylmethyl)benzamide has a molecular weight of 381.28 g/mol, XLogP of 4.53, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dichlorophenyl)-6-fluoro-N-(piperidin-4-ylmethyl)benzamide is sourced from PubChem (CID 46891022), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).