N-(4-fluorophenyl)-2-[4-(4-morpholin-4-ylphenyl)cyclohexyl]acetamide

C24H29FN2O2 — CID 121319959

IUPACN-(4-fluorophenyl)-2-[4-(4-morpholin-4-ylphenyl)cyclohexyl]acetamide
SMILESO=C(CC1CCC(c2ccc(N3CCOCC3)cc2)CC1)Nc1ccc(F)cc1
InChIInChI=1S/C24H29FN2O2/c25-21-7-9-22(10-8-21)26-24(28)17-18-1-3-19(4-2-18)20-5-11-23(12-6-20)27-13-15-29-16-14-27/h5-12,18-19H,1-4,13-17H2,(H,26,28)
InChIKeyARRFEKOXSSVVOK-UHFFFAOYSA-N
MW396.51 g/mol
LogP4.96
Rot. Bonds5

About N-(4-fluorophenyl)-2-[4-(4-morpholin-4-ylphenyl)cyclohexyl]acetamide

N-(4-fluorophenyl)-2-[4-(4-morpholin-4-ylphenyl)cyclohexyl]acetamide (PubChem CID 121319959) has the molecular formula C24H29FN2O2 and a molecular weight of 396.51 g/mol. Its IUPAC name is N-(4-fluorophenyl)-2-[4-(4-morpholin-4-ylphenyl)cyclohexyl]acetamide.

Molecular Properties

Compound NameN-(4-fluorophenyl)-2-[4-(4-morpholin-4-ylphenyl)cyclohexyl]acetamide
PubChem CID121319959
Molecular FormulaC24H29FN2O2
Molecular Weight396.51 g/mol
Exact Mass396.22
IUPAC NameN-(4-fluorophenyl)-2-[4-(4-morpholin-4-ylphenyl)cyclohexyl]acetamide
SMILESO=C(CC1CCC(c2ccc(N3CCOCC3)cc2)CC1)Nc1ccc(F)cc1
InChIInChI=1S/C24H29FN2O2/c25-21-7-9-22(10-8-21)26-24(28)17-18-1-3-19(4-2-18)20-5-11-23(12-6-20)27-13-15-29-16-14-27/h5-12,18-19H,1-4,13-17H2,(H,26,28)
InChIKeyARRFEKOXSSVVOK-UHFFFAOYSA-N
XLogP4.96
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500396.51
LogP ≤ 54.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_E(186)', 'substructure': 'N/A'}

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Related Compounds

2-(oxan-4-yl)-N-(4-pyrrolidin-1-ylphenyl)acetamide
CID 110862088
methyl 2-[4-(4-morpholin-4-ylphenyl)cyclohexyl]acetate
CID 118561959
2-[4-(4-fluorophenyl)piperazin-1-ium-1-yl]-N-(4-morpholin-4-ylphenyl)acetamide
CID 2478164
2-(4-fluorophenyl)sulfanyl-N-(4-morpholin-4-ylphenyl)acetamide
CID 2994341
N-(4-fluorophenyl)-2-[(3R)-oxolan-3-yl]acetamide
CID 126789596
2-cyclobutyl-N-(4-piperazin-1-ylphenyl)acetamide
CID 103162243
(3S)-3-(4-fluorophenyl)-5-(4-morpholin-4-ylanilino)-5-oxopentanoic acid
CID 100816087
2-cyclopentyl-N-[4-(4-methylpiperazin-1-yl)phenyl]acetamide
CID 51176688
2-[1-(4-fluorophenyl)piperidin-4-yl]-N-(2-oxo-3H-1,3-benzoxazol-6-yl)acetamide
CID 25256884
3-cyclohexyl-N-(4-morpholin-4-ylphenyl)propanamide
CID 7409256
3-(4-fluorophenyl)-1-methyl-1-[(4-morpholin-4-ylphenyl)methyl]urea
CID 27734751
2-(ethylamino)-N-(4-morpholin-4-ylphenyl)acetamide;dihydrochloride
CID 20847919

Frequently Asked Questions

What is the IUPAC name of N-(4-fluorophenyl)-2-[4-(4-morpholin-4-ylphenyl)cyclohexyl]acetamide?
The IUPAC name of N-(4-fluorophenyl)-2-[4-(4-morpholin-4-ylphenyl)cyclohexyl]acetamide (CID 121319959) is N-(4-fluorophenyl)-2-[4-(4-morpholin-4-ylphenyl)cyclohexyl]acetamide.
What is the SMILES notation for N-(4-fluorophenyl)-2-[4-(4-morpholin-4-ylphenyl)cyclohexyl]acetamide?
The canonical SMILES for N-(4-fluorophenyl)-2-[4-(4-morpholin-4-ylphenyl)cyclohexyl]acetamide is O=C(CC1CCC(c2ccc(N3CCOCC3)cc2)CC1)Nc1ccc(F)cc1.
What is the InChIKey of N-(4-fluorophenyl)-2-[4-(4-morpholin-4-ylphenyl)cyclohexyl]acetamide?
The InChIKey is ARRFEKOXSSVVOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H29FN2O2/c25-21-7-9-22(10-8-21)26-24(28)17-18-1-3-19(4-2-18)20-5-11-23(12-6-20)27-13-15-29-16-14-27/h5-12,18-19H,1-4,13-17H2,(H,26,28).
What are the key properties of N-(4-fluorophenyl)-2-[4-(4-morpholin-4-ylphenyl)cyclohexyl]acetamide?
N-(4-fluorophenyl)-2-[4-(4-morpholin-4-ylphenyl)cyclohexyl]acetamide has a molecular weight of 396.51 g/mol, XLogP of 4.96, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluorophenyl)-2-[4-(4-morpholin-4-ylphenyl)cyclohexyl]acetamide is sourced from PubChem (CID 121319959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).