2-amino-5-(6-ethyl-3-pyridinyl)-3-methyl-5-[3-(1,2-oxazol-3-yl)phenyl]imidazol-4-one

C20H19N5O2 — CID 146625373

IUPAC2-amino-5-(6-ethyl-3-pyridinyl)-3-methyl-5-[3-(1,2-oxazol-3-yl)phenyl]imidazol-4-one
SMILESCCc1ccc(C2(c3cccc(-c4ccon4)c3)N=C(N)N(C)C2=O)cn1
InChIInChI=1S/C20H19N5O2/c1-3-16-8-7-15(12-22-16)20(18(26)25(2)19(21)23-20)14-6-4-5-13(11-14)17-9-10-27-24-17/h4-12H,3H2,1-2H3,(H2,21,23)
InChIKeyKBWRYKPOEKFAHR-UHFFFAOYSA-N
MW361.41 g/mol
LogP2.33
Rot. Bonds4

About 2-amino-5-(6-ethyl-3-pyridinyl)-3-methyl-5-[3-(1,2-oxazol-3-yl)phenyl]imidazol-4-one

2-amino-5-(6-ethyl-3-pyridinyl)-3-methyl-5-[3-(1,2-oxazol-3-yl)phenyl]imidazol-4-one (PubChem CID 146625373) has the molecular formula C20H19N5O2 and a molecular weight of 361.41 g/mol. Its IUPAC name is 2-amino-5-(6-ethyl-3-pyridinyl)-3-methyl-5-[3-(1,2-oxazol-3-yl)phenyl]imidazol-4-one.

Molecular Properties

Compound Name2-amino-5-(6-ethyl-3-pyridinyl)-3-methyl-5-[3-(1,2-oxazol-3-yl)phenyl]imidazol-4-one
PubChem CID146625373
Molecular FormulaC20H19N5O2
Molecular Weight361.41 g/mol
Exact Mass361.15
IUPAC Name2-amino-5-(6-ethyl-3-pyridinyl)-3-methyl-5-[3-(1,2-oxazol-3-yl)phenyl]imidazol-4-one
SMILESCCc1ccc(C2(c3cccc(-c4ccon4)c3)N=C(N)N(C)C2=O)cn1
InChIInChI=1S/C20H19N5O2/c1-3-16-8-7-15(12-22-16)20(18(26)25(2)19(21)23-20)14-6-4-5-13(11-14)17-9-10-27-24-17/h4-12H,3H2,1-2H3,(H2,21,23)
InChIKeyKBWRYKPOEKFAHR-UHFFFAOYSA-N
XLogP2.33
TPSA97.61 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.41
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 2-amino-5-(6-ethyl-3-pyridinyl)-3-methyl-5-[3-(1,2-oxazol-3-yl)phenyl]imidazol-4-one with MolForge

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Related Compounds

2-amino-5-[6-(difluoromethyl)-3-pyridinyl]-5-[3-(furan-3-yl)phenyl]-3-methylimidazol-4-one
CID 146623019
2-amino-5-[2-(fluoromethyl)-4-pyridinyl]-3-methyl-5-(3-pyrimidin-5-ylphenyl)imidazol-4-one
CID 146622949
3-(6-ethyl-3-pyridinyl)-1,2-oxazole
CID 89020540
2-amino-3-methyl-5-[3-(1-methylimidazol-4-yl)phenyl]-5-[4-(pentafluoro-λ6-sulfanyl)phenyl]imidazol-4-one
CID 25119326
3-[3-[2-amino-4-[6-(difluoromethyl)-3-pyridinyl]-1-methyl-5-oxoimidazol-4-yl]phenyl]benzonitrile
CID 146623015
3-[3-(2-amino-1-methyl-5-oxo-4-phenylimidazol-4-yl)phenyl]benzamide
CID 25063752
2-[3-[2-amino-1-methyl-5-oxo-4-[4-(pentafluoro-λ6-sulfanyl)phenyl]imidazol-4-yl]phenyl]pyridine-4-carbonitrile
CID 25118977
2-amino-5-(4-methoxyphenyl)-3-methyl-5-(3-pyridin-3-ylphenyl)imidazol-4-one
CID 141128111
2-amino-5-[4-(difluoromethyl)-2-pyridinyl]-5-[2-fluoro-5-(1,2-oxazol-3-yl)phenyl]-3-methylimidazol-4-one
CID 146624692
2-amino-5-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-methyl-5-(3-pyridin-3-ylphenyl)imidazol-4-one
CID 11654224
2-amino-3-methyl-5-phenyl-5-(3-quinolin-5-ylphenyl)imidazol-4-one
CID 25063649
4-[2-amino-1-methyl-5-oxo-4-(3-pyridin-3-ylphenyl)imidazol-4-yl]-1-ethylpyrrole-2-carbaldehyde
CID 143389318

Frequently Asked Questions

What is the IUPAC name of 2-amino-5-(6-ethyl-3-pyridinyl)-3-methyl-5-[3-(1,2-oxazol-3-yl)phenyl]imidazol-4-one?
The IUPAC name of 2-amino-5-(6-ethyl-3-pyridinyl)-3-methyl-5-[3-(1,2-oxazol-3-yl)phenyl]imidazol-4-one (CID 146625373) is 2-amino-5-(6-ethyl-3-pyridinyl)-3-methyl-5-[3-(1,2-oxazol-3-yl)phenyl]imidazol-4-one.
What is the SMILES notation for 2-amino-5-(6-ethyl-3-pyridinyl)-3-methyl-5-[3-(1,2-oxazol-3-yl)phenyl]imidazol-4-one?
The canonical SMILES for 2-amino-5-(6-ethyl-3-pyridinyl)-3-methyl-5-[3-(1,2-oxazol-3-yl)phenyl]imidazol-4-one is CCc1ccc(C2(c3cccc(-c4ccon4)c3)N=C(N)N(C)C2=O)cn1.
What is the InChIKey of 2-amino-5-(6-ethyl-3-pyridinyl)-3-methyl-5-[3-(1,2-oxazol-3-yl)phenyl]imidazol-4-one?
The InChIKey is KBWRYKPOEKFAHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N5O2/c1-3-16-8-7-15(12-22-16)20(18(26)25(2)19(21)23-20)14-6-4-5-13(11-14)17-9-10-27-24-17/h4-12H,3H2,1-2H3,(H2,21,23).
What are the key properties of 2-amino-5-(6-ethyl-3-pyridinyl)-3-methyl-5-[3-(1,2-oxazol-3-yl)phenyl]imidazol-4-one?
2-amino-5-(6-ethyl-3-pyridinyl)-3-methyl-5-[3-(1,2-oxazol-3-yl)phenyl]imidazol-4-one has a molecular weight of 361.41 g/mol, XLogP of 2.33, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5-(6-ethyl-3-pyridinyl)-3-methyl-5-[3-(1,2-oxazol-3-yl)phenyl]imidazol-4-one is sourced from PubChem (CID 146625373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).