N-[4-[[3-[5-(3-fluorophenyl)-1H-imidazol-2-yl]morpholin-4-yl]methyl]phenyl]acetamide

C22H23FN4O2 — CID 78151226

IUPACN-[4-[[3-[5-(3-fluorophenyl)-1H-imidazol-2-yl]morpholin-4-yl]methyl]phenyl]acetamide
SMILESCC(=O)Nc1ccc(CN2CCOCC2c2ncc(-c3cccc(F)c3)[nH]2)cc1
InChIInChI=1S/C22H23FN4O2/c1-15(28)25-19-7-5-16(6-8-19)13-27-9-10-29-14-21(27)22-24-12-20(26-22)17-3-2-4-18(23)11-17/h2-8,11-12,21H,9-10,13-14H2,1H3,(H,24,26)(H,25,28)
InChIKeyKXHMQJNZBBVWRM-UHFFFAOYSA-N
MW394.45 g/mol
LogP3.75
Rot. Bonds5

About N-[4-[[3-[5-(3-fluorophenyl)-1H-imidazol-2-yl]morpholin-4-yl]methyl]phenyl]acetamide

N-[4-[[3-[5-(3-fluorophenyl)-1H-imidazol-2-yl]morpholin-4-yl]methyl]phenyl]acetamide (PubChem CID 78151226) has the molecular formula C22H23FN4O2 and a molecular weight of 394.45 g/mol. Its IUPAC name is N-[4-[[3-[5-(3-fluorophenyl)-1H-imidazol-2-yl]morpholin-4-yl]methyl]phenyl]acetamide.

Molecular Properties

Compound NameN-[4-[[3-[5-(3-fluorophenyl)-1H-imidazol-2-yl]morpholin-4-yl]methyl]phenyl]acetamide
PubChem CID78151226
Molecular FormulaC22H23FN4O2
Molecular Weight394.45 g/mol
Exact Mass394.18
IUPAC NameN-[4-[[3-[5-(3-fluorophenyl)-1H-imidazol-2-yl]morpholin-4-yl]methyl]phenyl]acetamide
SMILESCC(=O)Nc1ccc(CN2CCOCC2c2ncc(-c3cccc(F)c3)[nH]2)cc1
InChIInChI=1S/C22H23FN4O2/c1-15(28)25-19-7-5-16(6-8-19)13-27-9-10-29-14-21(27)22-24-12-20(26-22)17-3-2-4-18(23)11-17/h2-8,11-12,21H,9-10,13-14H2,1H3,(H,24,26)(H,25,28)
InChIKeyKXHMQJNZBBVWRM-UHFFFAOYSA-N
XLogP3.75
TPSA70.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500394.45
LogP ≤ 53.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-[4-[[3-[5-(3-fluorophenyl)-1H-imidazol-2-yl]morpholin-4-yl]methyl]phenyl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-[5-(3-chlorophenyl)-1H-imidazol-2-yl]-4-[(4-methylsulfonylphenyl)methyl]morpholine
CID 78151281
4-[[3-[5-(3-methoxyphenyl)-1H-imidazol-2-yl]morpholin-4-yl]methyl]-N,N-dimethylaniline
CID 78151248
3-[5-(3-chlorophenyl)-1H-imidazol-2-yl]-4-[(2-fluorophenyl)methyl]morpholine
CID 162916385
4-[[(3R)-3-[5-(4-methoxyphenyl)-1H-imidazol-2-yl]morpholin-4-yl]methyl]benzoic acid
CID 56776019
4-[(4-methylphenyl)methyl]-3-(5-pyridin-4-yl-1H-imidazol-2-yl)morpholine
CID 78151212
4-[(4-methylphenyl)methyl]-3-[5-(4-methylsulfonylphenyl)-1H-imidazol-2-yl]morpholine
CID 78151147
2-[[3-[5-(3-methoxyphenyl)-1H-imidazol-2-yl]morpholin-4-yl]methyl]phenol
CID 78151252
(3R)-3-[5-(4-methoxyphenyl)-1H-imidazol-2-yl]-4-[(4-methylphenyl)methyl]morpholine
CID 56776036
(3R)-3-[5-(3-chlorophenyl)-1H-imidazol-2-yl]-4-(1H-imidazol-5-ylmethyl)morpholine
CID 75529629
3-[5-(2,4-difluorophenyl)-1H-imidazol-2-yl]-4-(pyridin-3-ylmethyl)morpholine
CID 78151159
N-[4-[[(2S)-2-(3-fluorophenyl)azepan-1-yl]methyl]phenyl]acetamide
CID 99957918
2-[[3-[5-(2,4-difluorophenyl)-1H-imidazol-2-yl]morpholin-4-yl]methyl]phenol
CID 78151161

Frequently Asked Questions

What is the IUPAC name of N-[4-[[3-[5-(3-fluorophenyl)-1H-imidazol-2-yl]morpholin-4-yl]methyl]phenyl]acetamide?
The IUPAC name of N-[4-[[3-[5-(3-fluorophenyl)-1H-imidazol-2-yl]morpholin-4-yl]methyl]phenyl]acetamide (CID 78151226) is N-[4-[[3-[5-(3-fluorophenyl)-1H-imidazol-2-yl]morpholin-4-yl]methyl]phenyl]acetamide.
What is the SMILES notation for N-[4-[[3-[5-(3-fluorophenyl)-1H-imidazol-2-yl]morpholin-4-yl]methyl]phenyl]acetamide?
The canonical SMILES for N-[4-[[3-[5-(3-fluorophenyl)-1H-imidazol-2-yl]morpholin-4-yl]methyl]phenyl]acetamide is CC(=O)Nc1ccc(CN2CCOCC2c2ncc(-c3cccc(F)c3)[nH]2)cc1.
What is the InChIKey of N-[4-[[3-[5-(3-fluorophenyl)-1H-imidazol-2-yl]morpholin-4-yl]methyl]phenyl]acetamide?
The InChIKey is KXHMQJNZBBVWRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23FN4O2/c1-15(28)25-19-7-5-16(6-8-19)13-27-9-10-29-14-21(27)22-24-12-20(26-22)17-3-2-4-18(23)11-17/h2-8,11-12,21H,9-10,13-14H2,1H3,(H,24,26)(H,25,28).
What are the key properties of N-[4-[[3-[5-(3-fluorophenyl)-1H-imidazol-2-yl]morpholin-4-yl]methyl]phenyl]acetamide?
N-[4-[[3-[5-(3-fluorophenyl)-1H-imidazol-2-yl]morpholin-4-yl]methyl]phenyl]acetamide has a molecular weight of 394.45 g/mol, XLogP of 3.75, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[[3-[5-(3-fluorophenyl)-1H-imidazol-2-yl]morpholin-4-yl]methyl]phenyl]acetamide is sourced from PubChem (CID 78151226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).