5-chloro-2-fluoro-N-[(1-morpholin-4-ylcyclohexyl)methyl]benzamide

C18H24ClFN2O2 — CID 18150722

IUPAC5-chloro-2-fluoro-N-[(1-morpholin-4-ylcyclohexyl)methyl]benzamide
SMILESO=C(NCC1(N2CCOCC2)CCCCC1)c1cc(Cl)ccc1F
InChIInChI=1S/C18H24ClFN2O2/c19-14-4-5-16(20)15(12-14)17(23)21-13-18(6-2-1-3-7-18)22-8-10-24-11-9-22/h4-5,12H,1-3,6-11,13H2,(H,21,23)
InChIKeyZZPTVFBZGBRIPF-UHFFFAOYSA-N
MW354.85 g/mol
LogP3.24
Rot. Bonds4

About 5-chloro-2-fluoro-N-[(1-morpholin-4-ylcyclohexyl)methyl]benzamide

5-chloro-2-fluoro-N-[(1-morpholin-4-ylcyclohexyl)methyl]benzamide (PubChem CID 18150722) has the molecular formula C18H24ClFN2O2 and a molecular weight of 354.85 g/mol. Its IUPAC name is 5-chloro-2-fluoro-N-[(1-morpholin-4-ylcyclohexyl)methyl]benzamide.

Molecular Properties

Compound Name5-chloro-2-fluoro-N-[(1-morpholin-4-ylcyclohexyl)methyl]benzamide
PubChem CID18150722
Molecular FormulaC18H24ClFN2O2
Molecular Weight354.85 g/mol
Exact Mass354.15
IUPAC Name5-chloro-2-fluoro-N-[(1-morpholin-4-ylcyclohexyl)methyl]benzamide
SMILESO=C(NCC1(N2CCOCC2)CCCCC1)c1cc(Cl)ccc1F
InChIInChI=1S/C18H24ClFN2O2/c19-14-4-5-16(20)15(12-14)17(23)21-13-18(6-2-1-3-7-18)22-8-10-24-11-9-22/h4-5,12H,1-3,6-11,13H2,(H,21,23)
InChIKeyZZPTVFBZGBRIPF-UHFFFAOYSA-N
XLogP3.24
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.85
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2,5-dichloro-N-[(1-morpholin-4-ylcyclobutyl)methyl]benzamide
CID 139027826
2-fluoro-N-[(1-morpholin-4-ylcyclohexyl)methyl]benzamide;hydrochloride
CID 20995028
4-chloro-N-[(1-morpholin-4-ylcyclohexyl)methyl]-2-nitrobenzamide
CID 18150649
2-(4-fluorobenzoyl)-N-[(1-morpholin-4-ylcyclohexyl)methyl]benzamide
CID 39430130
3-fluoro-N-[(1-morpholin-4-ylcyclobutyl)methyl]benzamide
CID 139028737
2-(3,4-dichlorophenyl)-N-[(1-morpholin-4-ylcyclohexyl)methyl]acetamide
CID 2542286
[2-[(1-morpholin-4-ylcyclohexyl)methylamino]-2-oxoethyl] 4-chloro-2-hydroxybenzoate
CID 55536838
2-fluoro-N-[(4-morpholin-4-ylthian-4-yl)methyl]benzamide
CID 139028683
4-methyl-N-[(1-morpholin-4-ylcyclohexyl)methyl]benzamide
CID 2559826
3-fluoro-N-[2-[(1-morpholin-4-ylcyclohexyl)methylamino]-2-oxoethyl]benzamide
CID 78784195
2,4-dichloro-5-fluoro-N-[(1-thiomorpholin-4-ylcyclopentyl)methyl]benzamide
CID 39177580
2-(3-chlorophenoxy)-N-[(1-morpholin-4-ylcyclohexyl)methyl]acetamide;hydrochloride
CID 20994956

Frequently Asked Questions

What is the IUPAC name of 5-chloro-2-fluoro-N-[(1-morpholin-4-ylcyclohexyl)methyl]benzamide?
The IUPAC name of 5-chloro-2-fluoro-N-[(1-morpholin-4-ylcyclohexyl)methyl]benzamide (CID 18150722) is 5-chloro-2-fluoro-N-[(1-morpholin-4-ylcyclohexyl)methyl]benzamide.
What is the SMILES notation for 5-chloro-2-fluoro-N-[(1-morpholin-4-ylcyclohexyl)methyl]benzamide?
The canonical SMILES for 5-chloro-2-fluoro-N-[(1-morpholin-4-ylcyclohexyl)methyl]benzamide is O=C(NCC1(N2CCOCC2)CCCCC1)c1cc(Cl)ccc1F.
What is the InChIKey of 5-chloro-2-fluoro-N-[(1-morpholin-4-ylcyclohexyl)methyl]benzamide?
The InChIKey is ZZPTVFBZGBRIPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24ClFN2O2/c19-14-4-5-16(20)15(12-14)17(23)21-13-18(6-2-1-3-7-18)22-8-10-24-11-9-22/h4-5,12H,1-3,6-11,13H2,(H,21,23).
What are the key properties of 5-chloro-2-fluoro-N-[(1-morpholin-4-ylcyclohexyl)methyl]benzamide?
5-chloro-2-fluoro-N-[(1-morpholin-4-ylcyclohexyl)methyl]benzamide has a molecular weight of 354.85 g/mol, XLogP of 3.24, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-2-fluoro-N-[(1-morpholin-4-ylcyclohexyl)methyl]benzamide is sourced from PubChem (CID 18150722), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).