2-amino-4-phenyl-4-(3-pyrimidin-5-ylphenyl)-1H-imidazol-5-one

C19H15N5O — CID 143064638

IUPAC2-amino-4-phenyl-4-(3-pyrimidin-5-ylphenyl)-1H-imidazol-5-one
SMILESNC1=NC(c2ccccc2)(c2cccc(-c3cncnc3)c2)C(=O)N1
InChIInChI=1S/C19H15N5O/c20-18-23-17(25)19(24-18,15-6-2-1-3-7-15)16-8-4-5-13(9-16)14-10-21-12-22-11-14/h1-12H,(H3,20,23,24,25)
InChIKeyPUVOHUJBNAUJSN-UHFFFAOYSA-N
MW329.36 g/mol
LogP1.83
Rot. Bonds3

About 2-amino-4-phenyl-4-(3-pyrimidin-5-ylphenyl)-1H-imidazol-5-one

2-amino-4-phenyl-4-(3-pyrimidin-5-ylphenyl)-1H-imidazol-5-one (PubChem CID 143064638) has the molecular formula C19H15N5O and a molecular weight of 329.36 g/mol. Its IUPAC name is 2-amino-4-phenyl-4-(3-pyrimidin-5-ylphenyl)-1H-imidazol-5-one.

Molecular Properties

Compound Name2-amino-4-phenyl-4-(3-pyrimidin-5-ylphenyl)-1H-imidazol-5-one
PubChem CID143064638
Molecular FormulaC19H15N5O
Molecular Weight329.36 g/mol
Exact Mass329.13
IUPAC Name2-amino-4-phenyl-4-(3-pyrimidin-5-ylphenyl)-1H-imidazol-5-one
SMILESNC1=NC(c2ccccc2)(c2cccc(-c3cncnc3)c2)C(=O)N1
InChIInChI=1S/C19H15N5O/c20-18-23-17(25)19(24-18,15-6-2-1-3-7-15)16-8-4-5-13(9-16)14-10-21-12-22-11-14/h1-12H,(H3,20,23,24,25)
InChIKeyPUVOHUJBNAUJSN-UHFFFAOYSA-N
XLogP1.83
TPSA93.26 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.36
LogP ≤ 51.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-amino-4-(3-pyrimidin-5-ylphenyl)-4-(1,3-thiazol-4-yl)-1H-imidazol-5-one
CID 71220455
3-pyrimidin-5-ylaniline
CID 7162049
5-pyridin-4-yl-5-(3-pyrimidin-5-ylphenyl)pyrrolo[3,4-b]pyridin-7-amine
CID 25119893
5-methyl-5-(3-pyrimidin-5-ylphenyl)-2,6-dihydro-1,2,4-oxadiazin-3-amine
CID 70326750
5-(3-pyrimidin-5-ylphenyl)pyrimidine
CID 101127667
(5R)-2-amino-5-(4-methoxy-3-methylphenyl)-3-methyl-5-(3-pyrimidin-5-ylphenyl)imidazol-4-one
CID 11682506
3-(1,3-benzodioxol-5-yl)-3-(3-pyrimidin-5-ylphenyl)isoindol-1-amine;2,2,2-trifluoroacetic acid
CID 24875095
3-(4-methoxy-3-methylphenyl)-3-(3-pyrimidin-5-ylphenyl)isoindol-1-amine;2,2,2-trifluoroacetic acid
CID 24875042
2-amino-5-(5-chloro-2-methylthiophen-3-yl)-3-methyl-5-(3-pyrimidin-5-ylphenyl)imidazol-4-one
CID 68699312
2-amino-5-[2-(fluoromethyl)-4-pyridinyl]-3-methyl-5-(3-pyrimidin-5-ylphenyl)imidazol-4-one
CID 146622949
3,3-difluoro-8-pyridin-4-yl-8-(3-pyrimidin-5-ylphenyl)-2,4-dihydroimidazo[1,5-a]pyrimidin-6-amine
CID 24871744
3-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(3-pyrimidin-5-ylphenyl)isoindol-1-amine
CID 59596313

Frequently Asked Questions

What is the IUPAC name of 2-amino-4-phenyl-4-(3-pyrimidin-5-ylphenyl)-1H-imidazol-5-one?
The IUPAC name of 2-amino-4-phenyl-4-(3-pyrimidin-5-ylphenyl)-1H-imidazol-5-one (CID 143064638) is 2-amino-4-phenyl-4-(3-pyrimidin-5-ylphenyl)-1H-imidazol-5-one.
What is the SMILES notation for 2-amino-4-phenyl-4-(3-pyrimidin-5-ylphenyl)-1H-imidazol-5-one?
The canonical SMILES for 2-amino-4-phenyl-4-(3-pyrimidin-5-ylphenyl)-1H-imidazol-5-one is NC1=NC(c2ccccc2)(c2cccc(-c3cncnc3)c2)C(=O)N1.
What is the InChIKey of 2-amino-4-phenyl-4-(3-pyrimidin-5-ylphenyl)-1H-imidazol-5-one?
The InChIKey is PUVOHUJBNAUJSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15N5O/c20-18-23-17(25)19(24-18,15-6-2-1-3-7-15)16-8-4-5-13(9-16)14-10-21-12-22-11-14/h1-12H,(H3,20,23,24,25).
What are the key properties of 2-amino-4-phenyl-4-(3-pyrimidin-5-ylphenyl)-1H-imidazol-5-one?
2-amino-4-phenyl-4-(3-pyrimidin-5-ylphenyl)-1H-imidazol-5-one has a molecular weight of 329.36 g/mol, XLogP of 1.83, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-4-phenyl-4-(3-pyrimidin-5-ylphenyl)-1H-imidazol-5-one is sourced from PubChem (CID 143064638), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).