3-[[2-amino-4,4-bis(4-fluorophenyl)-5-oxoimidazol-1-yl]methyl]-N-methyl-N-(pyridin-3-ylmethyl)benzamide

C30H25F2N5O2 — CID 135154313

IUPAC3-[[2-amino-4,4-bis(4-fluorophenyl)-5-oxoimidazol-1-yl]methyl]-N-methyl-N-(pyridin-3-ylmethyl)benzamide
SMILESCN(Cc1cccnc1)C(=O)c1cccc(CN2C(=O)C(c3ccc(F)cc3)(c3ccc(F)cc3)N=C2N)c1
InChIInChI=1S/C30H25F2N5O2/c1-36(18-21-5-3-15-34-17-21)27(38)22-6-2-4-20(16-22)19-37-28(39)30(35-29(37)33,23-7-11-25(31)12-8-23)24-9-13-26(32)14-10-24/h2-17H,18-19H2,1H3,(H2,33,35)
InChIKeyRMAVBLFYZMUFOT-UHFFFAOYSA-N
MW525.56 g/mol
LogP4.23
Rot. Bonds7

About 3-[[2-amino-4,4-bis(4-fluorophenyl)-5-oxoimidazol-1-yl]methyl]-N-methyl-N-(pyridin-3-ylmethyl)benzamide

3-[[2-amino-4,4-bis(4-fluorophenyl)-5-oxoimidazol-1-yl]methyl]-N-methyl-N-(pyridin-3-ylmethyl)benzamide (PubChem CID 135154313) has the molecular formula C30H25F2N5O2 and a molecular weight of 525.56 g/mol. Its IUPAC name is 3-[[2-amino-4,4-bis(4-fluorophenyl)-5-oxoimidazol-1-yl]methyl]-N-methyl-N-(pyridin-3-ylmethyl)benzamide.

Molecular Properties

Compound Name3-[[2-amino-4,4-bis(4-fluorophenyl)-5-oxoimidazol-1-yl]methyl]-N-methyl-N-(pyridin-3-ylmethyl)benzamide
PubChem CID135154313
Molecular FormulaC30H25F2N5O2
Molecular Weight525.56 g/mol
Exact Mass525.20
IUPAC Name3-[[2-amino-4,4-bis(4-fluorophenyl)-5-oxoimidazol-1-yl]methyl]-N-methyl-N-(pyridin-3-ylmethyl)benzamide
SMILESCN(Cc1cccnc1)C(=O)c1cccc(CN2C(=O)C(c3ccc(F)cc3)(c3ccc(F)cc3)N=C2N)c1
InChIInChI=1S/C30H25F2N5O2/c1-36(18-21-5-3-15-34-17-21)27(38)22-6-2-4-20(16-22)19-37-28(39)30(35-29(37)33,23-7-11-25(31)12-8-23)24-9-13-26(32)14-10-24/h2-17H,18-19H2,1H3,(H2,33,35)
InChIKeyRMAVBLFYZMUFOT-UHFFFAOYSA-N
XLogP4.23
TPSA91.89 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms39
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500525.56
LogP ≤ 54.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 3-[[2-amino-4,4-bis(4-fluorophenyl)-5-oxoimidazol-1-yl]methyl]-N-methyl-N-(pyridin-3-ylmethyl)benzamide 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-[(2-amino-5-oxo-4,4-diphenylimidazol-1-yl)methyl]-N-(2-pyridin-3-ylethyl)benzamide
CID 59388257
3-[(2-amino-5-oxo-4,4-diphenylimidazol-1-yl)methyl]-N-methyl-N-(1-phenylethyl)benzamide
CID 155059056
3-[2-amino-1-[[3-(1,3-dihydroisoindole-2-carbonyl)phenyl]methyl]-4-(4-fluorophenyl)-5-oxoimidazol-4-yl]benzonitrile
CID 135155903
2-amino-4-fluoro-N-methyl-N-(pyridin-3-ylmethyl)benzamide
CID 63109669
N-(4-fluorophenyl)-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide
CID 110360828
methyl N-[6-[3-[[2-amino-4,4-bis(4-fluorophenyl)-5-oxoimidazol-1-yl]methyl]benzoyl]-5,7-dihydropyrrolo[3,4-d]pyrimidin-2-yl]carbamate
CID 135181550
3-[(2-amino-5-oxo-4-phenyl-4-propylimidazol-1-yl)methyl]-N-[(5-chloro-2-pyridinyl)methyl]-N-methylbenzamide
CID 142387043
2-amino-3-[[3-(6-fluoro-3,4-dihydro-1H-isoquinoline-2-carbonyl)phenyl]methyl]-5,5-diphenylimidazol-4-one
CID 135155854
N-(4-fluorophenyl)-3-methoxy-N-(pyridin-3-ylmethyl)benzamide
CID 110360811
3,5-dihydroxy-N-methyl-N-(pyridin-3-ylmethyl)benzamide
CID 103891587
3-[(2-amino-5-oxo-4,4-diphenylimidazol-1-yl)methyl]-N-butan-2-ylbenzamide
CID 59387294
N-methyl-N-(pyridin-3-ylmethyl)-3H-benzimidazole-5-carboxamide
CID 43397556

Frequently Asked Questions

What is the IUPAC name of 3-[[2-amino-4,4-bis(4-fluorophenyl)-5-oxoimidazol-1-yl]methyl]-N-methyl-N-(pyridin-3-ylmethyl)benzamide?
The IUPAC name of 3-[[2-amino-4,4-bis(4-fluorophenyl)-5-oxoimidazol-1-yl]methyl]-N-methyl-N-(pyridin-3-ylmethyl)benzamide (CID 135154313) is 3-[[2-amino-4,4-bis(4-fluorophenyl)-5-oxoimidazol-1-yl]methyl]-N-methyl-N-(pyridin-3-ylmethyl)benzamide.
What is the SMILES notation for 3-[[2-amino-4,4-bis(4-fluorophenyl)-5-oxoimidazol-1-yl]methyl]-N-methyl-N-(pyridin-3-ylmethyl)benzamide?
The canonical SMILES for 3-[[2-amino-4,4-bis(4-fluorophenyl)-5-oxoimidazol-1-yl]methyl]-N-methyl-N-(pyridin-3-ylmethyl)benzamide is CN(Cc1cccnc1)C(=O)c1cccc(CN2C(=O)C(c3ccc(F)cc3)(c3ccc(F)cc3)N=C2N)c1.
What is the InChIKey of 3-[[2-amino-4,4-bis(4-fluorophenyl)-5-oxoimidazol-1-yl]methyl]-N-methyl-N-(pyridin-3-ylmethyl)benzamide?
The InChIKey is RMAVBLFYZMUFOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H25F2N5O2/c1-36(18-21-5-3-15-34-17-21)27(38)22-6-2-4-20(16-22)19-37-28(39)30(35-29(37)33,23-7-11-25(31)12-8-23)24-9-13-26(32)14-10-24/h2-17H,18-19H2,1H3,(H2,33,35).
What are the key properties of 3-[[2-amino-4,4-bis(4-fluorophenyl)-5-oxoimidazol-1-yl]methyl]-N-methyl-N-(pyridin-3-ylmethyl)benzamide?
3-[[2-amino-4,4-bis(4-fluorophenyl)-5-oxoimidazol-1-yl]methyl]-N-methyl-N-(pyridin-3-ylmethyl)benzamide has a molecular weight of 525.56 g/mol, XLogP of 4.23, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[2-amino-4,4-bis(4-fluorophenyl)-5-oxoimidazol-1-yl]methyl]-N-methyl-N-(pyridin-3-ylmethyl)benzamide is sourced from PubChem (CID 135154313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).