2-chloro-6-fluoro-N-[2-(2-phenylmorpholin-4-yl)ethyl]benzamide

C19H20ClFN2O2 — CID 16892429

IUPAC2-chloro-6-fluoro-N-[2-(2-phenylmorpholin-4-yl)ethyl]benzamide
SMILESO=C(NCCN1CCOC(c2ccccc2)C1)c1c(F)cccc1Cl
InChIInChI=1S/C19H20ClFN2O2/c20-15-7-4-8-16(21)18(15)19(24)22-9-10-23-11-12-25-17(13-23)14-5-2-1-3-6-14/h1-8,17H,9-13H2,(H,22,24)
InChIKeyVESPJRKFSMASDZ-UHFFFAOYSA-N
MW362.83 g/mol
LogP3.28
Rot. Bonds5

About 2-chloro-6-fluoro-N-[2-(2-phenylmorpholin-4-yl)ethyl]benzamide

2-chloro-6-fluoro-N-[2-(2-phenylmorpholin-4-yl)ethyl]benzamide (PubChem CID 16892429) has the molecular formula C19H20ClFN2O2 and a molecular weight of 362.83 g/mol. Its IUPAC name is 2-chloro-6-fluoro-N-[2-(2-phenylmorpholin-4-yl)ethyl]benzamide.

Molecular Properties

Compound Name2-chloro-6-fluoro-N-[2-(2-phenylmorpholin-4-yl)ethyl]benzamide
PubChem CID16892429
Molecular FormulaC19H20ClFN2O2
Molecular Weight362.83 g/mol
Exact Mass362.12
IUPAC Name2-chloro-6-fluoro-N-[2-(2-phenylmorpholin-4-yl)ethyl]benzamide
SMILESO=C(NCCN1CCOC(c2ccccc2)C1)c1c(F)cccc1Cl
InChIInChI=1S/C19H20ClFN2O2/c20-15-7-4-8-16(21)18(15)19(24)22-9-10-23-11-12-25-17(13-23)14-5-2-1-3-6-14/h1-8,17H,9-13H2,(H,22,24)
InChIKeyVESPJRKFSMASDZ-UHFFFAOYSA-N
XLogP3.28
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.83
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[(6S,7R)-7-(4-chloro-3-fluorophenyl)-1,4-oxazepan-6-yl]methyl]benzamide;hydrochloride
CID 66976494
(2-Chloro-6-fluorophenyl)methyl 2-[(4-methylbenzoyl)amino]acetate
CID 954137
2-chlorobenzyl N-benzoylglycylglycinate
CID 2953495
2,4-dichloro-N-[(4S,5S)-2,2-dimethyl-4-phenyl-1,3-dioxan-5-yl]benzamide
CID 44393338
[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl] 2-chloro-6-fluorobenzoate
CID 2357964
N-[2-(benzyloxy)ethyl]-2-chlorobenzamide
CID 2222859
4-chloro-N-[[4-[(2R)-morpholin-2-yl]phenyl]methyl]benzamide
CID 58315590
3-chloro-N-[[4-[(2S)-morpholin-2-yl]phenyl]methyl]benzamide
CID 58315691
4-chloro-N-[[4-[(2S)-morpholin-2-yl]phenyl]methyl]benzamide
CID 58315752
3-chloro-N-[[4-[(2R)-morpholin-2-yl]phenyl]methyl]benzamide
CID 58315802
2-[(2-Chloro-6-fluorobenzoyl)amino]ethyl 2-chloro-6-fluorobenzoate
CID 2726053
2-chloro-N-[3-[[2-(4-fluorophenyl)-2-morpholin-4-ylethyl]amino]-3-oxopropyl]benzamide
CID 18136223

Frequently Asked Questions

What is the IUPAC name of 2-chloro-6-fluoro-N-[2-(2-phenylmorpholin-4-yl)ethyl]benzamide?
The IUPAC name of 2-chloro-6-fluoro-N-[2-(2-phenylmorpholin-4-yl)ethyl]benzamide (CID 16892429) is 2-chloro-6-fluoro-N-[2-(2-phenylmorpholin-4-yl)ethyl]benzamide.
What is the SMILES notation for 2-chloro-6-fluoro-N-[2-(2-phenylmorpholin-4-yl)ethyl]benzamide?
The canonical SMILES for 2-chloro-6-fluoro-N-[2-(2-phenylmorpholin-4-yl)ethyl]benzamide is O=C(NCCN1CCOC(c2ccccc2)C1)c1c(F)cccc1Cl.
What is the InChIKey of 2-chloro-6-fluoro-N-[2-(2-phenylmorpholin-4-yl)ethyl]benzamide?
The InChIKey is VESPJRKFSMASDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20ClFN2O2/c20-15-7-4-8-16(21)18(15)19(24)22-9-10-23-11-12-25-17(13-23)14-5-2-1-3-6-14/h1-8,17H,9-13H2,(H,22,24).
What are the key properties of 2-chloro-6-fluoro-N-[2-(2-phenylmorpholin-4-yl)ethyl]benzamide?
2-chloro-6-fluoro-N-[2-(2-phenylmorpholin-4-yl)ethyl]benzamide has a molecular weight of 362.83 g/mol, XLogP of 3.28, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-6-fluoro-N-[2-(2-phenylmorpholin-4-yl)ethyl]benzamide is sourced from PubChem (CID 16892429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).