3-[1-hydroxy-5-(4-morpholin-4-ylphenyl)imidazol-2-yl]-4-methyl-1H-pyridin-2-one

C19H20N4O3 — CID 143097835

IUPAC3-[1-hydroxy-5-(4-morpholin-4-ylphenyl)imidazol-2-yl]-4-methyl-1H-pyridin-2-one
SMILESCc1cc[nH]c(=O)c1-c1ncc(-c2ccc(N3CCOCC3)cc2)n1O
InChIInChI=1S/C19H20N4O3/c1-13-6-7-20-19(24)17(13)18-21-12-16(23(18)25)14-2-4-15(5-3-14)22-8-10-26-11-9-22/h2-7,12,25H,8-11H2,1H3,(H,20,24)
InChIKeyREWYBSNPMSRIHK-UHFFFAOYSA-N
MW352.39 g/mol
LogP2.29
Rot. Bonds3

About 3-[1-hydroxy-5-(4-morpholin-4-ylphenyl)imidazol-2-yl]-4-methyl-1H-pyridin-2-one

3-[1-hydroxy-5-(4-morpholin-4-ylphenyl)imidazol-2-yl]-4-methyl-1H-pyridin-2-one (PubChem CID 143097835) has the molecular formula C19H20N4O3 and a molecular weight of 352.39 g/mol. Its IUPAC name is 3-[1-hydroxy-5-(4-morpholin-4-ylphenyl)imidazol-2-yl]-4-methyl-1H-pyridin-2-one.

Molecular Properties

Compound Name3-[1-hydroxy-5-(4-morpholin-4-ylphenyl)imidazol-2-yl]-4-methyl-1H-pyridin-2-one
PubChem CID143097835
Molecular FormulaC19H20N4O3
Molecular Weight352.39 g/mol
Exact Mass352.15
IUPAC Name3-[1-hydroxy-5-(4-morpholin-4-ylphenyl)imidazol-2-yl]-4-methyl-1H-pyridin-2-one
SMILESCc1cc[nH]c(=O)c1-c1ncc(-c2ccc(N3CCOCC3)cc2)n1O
InChIInChI=1S/C19H20N4O3/c1-13-6-7-20-19(24)17(13)18-21-12-16(23(18)25)14-2-4-15(5-3-14)22-8-10-26-11-9-22/h2-7,12,25H,8-11H2,1H3,(H,20,24)
InChIKeyREWYBSNPMSRIHK-UHFFFAOYSA-N
XLogP2.29
TPSA83.38 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.39
LogP ≤ 52.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'N-hydroxyl_pyridine', 'substructure': 'N/A'}

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Related Compounds

4-[4-(2-methyl-1H-imidazol-5-yl)phenyl]morpholine
CID 58874981
5-[4-(aminomethyl)phenyl]-8-(4-morpholin-4-ylanilino)-2H-2,7-naphthyridin-1-one
CID 58094662
N-(2,4-dimorpholin-4-ylphenyl)-3-methyl-1H-pyrrole-2-carboxamide
CID 167806321
16-(4-methylphenyl)-1,4,7,10,13-pentaoxa-16-azacyclooctadecane
CID 71419396
13-[4-[4-(1,4,7,10-tetraoxa-13-azacyclopentadec-13-yl)phenyl]phenyl]-1,4,7,10-tetraoxa-13-azacyclopentadecane
CID 102533214
1-(3,4-dimethylphenyl)-N-(5-morpholin-4-yl-2-pyridinyl)-2-oxopyrrolidine-3-carboxamide
CID 51124677
1-(2,2-dimethylcyclopentyl)-3-(4-morpholin-4-ylphenyl)-5H-pyrazolo[4,3-c]pyridin-4-one
CID 137010576
1-methyl-5-(4-morpholin-4-ylphenyl)pyrazole-3-carboxylic acid
CID 112710654
5-(hydroxymethyl)-3-(4-morpholin-4-ylphenyl)-1,3-oxazolidin-2-one
CID 22014481
6-(6-fluoro-3-pyridinyl)-8-(4-morpholin-4-ylanilino)-2H-2,7-naphthyridin-1-one
CID 58093889
4-methyl-3-[4-[2-[2-methyl-5-(2-morpholin-4-ylethoxy)anilino]-1,3-oxazol-5-yl]-2-pyridinyl]-1H-pyridin-2-one
CID 71243476
2-[5-(4-morpholin-4-ylphenyl)-2-pyridinyl]acetamide
CID 90005107

Frequently Asked Questions

What is the IUPAC name of 3-[1-hydroxy-5-(4-morpholin-4-ylphenyl)imidazol-2-yl]-4-methyl-1H-pyridin-2-one?
The IUPAC name of 3-[1-hydroxy-5-(4-morpholin-4-ylphenyl)imidazol-2-yl]-4-methyl-1H-pyridin-2-one (CID 143097835) is 3-[1-hydroxy-5-(4-morpholin-4-ylphenyl)imidazol-2-yl]-4-methyl-1H-pyridin-2-one.
What is the SMILES notation for 3-[1-hydroxy-5-(4-morpholin-4-ylphenyl)imidazol-2-yl]-4-methyl-1H-pyridin-2-one?
The canonical SMILES for 3-[1-hydroxy-5-(4-morpholin-4-ylphenyl)imidazol-2-yl]-4-methyl-1H-pyridin-2-one is Cc1cc[nH]c(=O)c1-c1ncc(-c2ccc(N3CCOCC3)cc2)n1O.
What is the InChIKey of 3-[1-hydroxy-5-(4-morpholin-4-ylphenyl)imidazol-2-yl]-4-methyl-1H-pyridin-2-one?
The InChIKey is REWYBSNPMSRIHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N4O3/c1-13-6-7-20-19(24)17(13)18-21-12-16(23(18)25)14-2-4-15(5-3-14)22-8-10-26-11-9-22/h2-7,12,25H,8-11H2,1H3,(H,20,24).
What are the key properties of 3-[1-hydroxy-5-(4-morpholin-4-ylphenyl)imidazol-2-yl]-4-methyl-1H-pyridin-2-one?
3-[1-hydroxy-5-(4-morpholin-4-ylphenyl)imidazol-2-yl]-4-methyl-1H-pyridin-2-one has a molecular weight of 352.39 g/mol, XLogP of 2.29, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[1-hydroxy-5-(4-morpholin-4-ylphenyl)imidazol-2-yl]-4-methyl-1H-pyridin-2-one is sourced from PubChem (CID 143097835), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).