3-[3-(2-amino-1-methyl-5-oxo-4-phenylimidazol-4-yl)phenyl]benzamide

C23H20N4O2 — CID 25063752

IUPAC3-[3-(2-amino-1-methyl-5-oxo-4-phenylimidazol-4-yl)phenyl]benzamide
SMILESCN1C(=O)C(c2ccccc2)(c2cccc(-c3cccc(C(N)=O)c3)c2)N=C1N
InChIInChI=1S/C23H20N4O2/c1-27-21(29)23(26-22(27)25,18-10-3-2-4-11-18)19-12-6-8-16(14-19)15-7-5-9-17(13-15)20(24)28/h2-14H,1H3,(H2,24,28)(H2,25,26)
InChIKeyRXYBVCDZBDKRIG-UHFFFAOYSA-N
MW384.44 g/mol
LogP2.48
Rot. Bonds4

About 3-[3-(2-amino-1-methyl-5-oxo-4-phenylimidazol-4-yl)phenyl]benzamide

3-[3-(2-amino-1-methyl-5-oxo-4-phenylimidazol-4-yl)phenyl]benzamide (PubChem CID 25063752) has the molecular formula C23H20N4O2 and a molecular weight of 384.44 g/mol. Its IUPAC name is 3-[3-(2-amino-1-methyl-5-oxo-4-phenylimidazol-4-yl)phenyl]benzamide.

Molecular Properties

Compound Name3-[3-(2-amino-1-methyl-5-oxo-4-phenylimidazol-4-yl)phenyl]benzamide
PubChem CID25063752
Molecular FormulaC23H20N4O2
Molecular Weight384.44 g/mol
Exact Mass384.16
IUPAC Name3-[3-(2-amino-1-methyl-5-oxo-4-phenylimidazol-4-yl)phenyl]benzamide
SMILESCN1C(=O)C(c2ccccc2)(c2cccc(-c3cccc(C(N)=O)c3)c2)N=C1N
InChIInChI=1S/C23H20N4O2/c1-27-21(29)23(26-22(27)25,18-10-3-2-4-11-18)19-12-6-8-16(14-19)15-7-5-9-17(13-15)20(24)28/h2-14H,1H3,(H2,24,28)(H2,25,26)
InChIKeyRXYBVCDZBDKRIG-UHFFFAOYSA-N
XLogP2.48
TPSA101.78 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.44
LogP ≤ 52.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(2e)-2-Imino-3-Methyl-5,5-Diphenylimidazolidin-4-One
CID 15054176
N-Benzyl-3-{[(2z,4s)-2-Imino-4-Methyl-6-Oxo-4-(Propan-2-Yl)tetrahydropyrimidin-1(2h)-Yl]methyl}benzamide
CID 71738909
3-[(R)-[(2E,4S)-2-imino-4-methyl-6-oxo-4-(propan-2-yl)-1,3-diazinan-1-yl](phenyl)methyl]-N-[(1S)-1-phenylethyl]benzamide
CID 163201233
3-[(R)-(2-amino-4,4-diethyl-6-oxo-5H-pyrimidin-1-yl)-phenylmethyl]-N-[(1S)-1-phenylethyl]benzamide
CID 168279128
3-[3-(2-Amino-4-cyclopropyl-1-methyl-5-oxoimidazol-4-yl)phenyl]benzonitrile
CID 11624078
5-Adamantan-1-yl-2-amino-3-methyl-5-phenyl-3,5-dihydro-imidazol-4-one
CID 16050640
2-amino-4-cyclohexyl-1-methyl-4-phenyl-1H-imidazol-5(4H)-one
CID 16050931
2-amino-1-benzyl-4-cyclohexyl-4-phenyl-1H-imidazol-5(4H)-one
CID 16051038
2-amino-4-cyclohexyl-1-hexyl-4-phenyl-1H-imidazol-5(4H)-one
CID 16051040
2-Amino-3-cyclohexyl-5,5-diphenylimidazol-4-one
CID 44530523
2-Amino-3-pentyl-5,5-diphenylimidazol-4-one
CID 44530658
2-Amino-5,5-diphenyl-3-(2-phenylbutyl)imidazol-4-one
CID 44530662

Frequently Asked Questions

What is the IUPAC name of 3-[3-(2-amino-1-methyl-5-oxo-4-phenylimidazol-4-yl)phenyl]benzamide?
The IUPAC name of 3-[3-(2-amino-1-methyl-5-oxo-4-phenylimidazol-4-yl)phenyl]benzamide (CID 25063752) is 3-[3-(2-amino-1-methyl-5-oxo-4-phenylimidazol-4-yl)phenyl]benzamide.
What is the SMILES notation for 3-[3-(2-amino-1-methyl-5-oxo-4-phenylimidazol-4-yl)phenyl]benzamide?
The canonical SMILES for 3-[3-(2-amino-1-methyl-5-oxo-4-phenylimidazol-4-yl)phenyl]benzamide is CN1C(=O)C(c2ccccc2)(c2cccc(-c3cccc(C(N)=O)c3)c2)N=C1N.
What is the InChIKey of 3-[3-(2-amino-1-methyl-5-oxo-4-phenylimidazol-4-yl)phenyl]benzamide?
The InChIKey is RXYBVCDZBDKRIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20N4O2/c1-27-21(29)23(26-22(27)25,18-10-3-2-4-11-18)19-12-6-8-16(14-19)15-7-5-9-17(13-15)20(24)28/h2-14H,1H3,(H2,24,28)(H2,25,26).
What are the key properties of 3-[3-(2-amino-1-methyl-5-oxo-4-phenylimidazol-4-yl)phenyl]benzamide?
3-[3-(2-amino-1-methyl-5-oxo-4-phenylimidazol-4-yl)phenyl]benzamide has a molecular weight of 384.44 g/mol, XLogP of 2.48, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3-(2-amino-1-methyl-5-oxo-4-phenylimidazol-4-yl)phenyl]benzamide is sourced from PubChem (CID 25063752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).