3-[(1-acetylpiperidin-4-yl)methyl]-2-amino-5-methyl-5-[3-(3-methylphenyl)phenyl]imidazol-4-one;2-amino-3-butyl-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropylimidazol-4-one;2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(2-methylpropyl)imidazol-4-one;N-[(1R,3S)-3-[[(4R)-2-amino-4-(2-cyclohexylethyl)-1-methyl-5-oxoimidazol-4-yl]methyl]cyclohexyl]-6-methylpyridine-3-carboxamide;N-[3-(2-amino-1-methyl-5-oxo-4-phenylimidazol-4-yl)phenyl]pyridine-2-carboxamide

C117H136Cl2N20O8 — CID 158534855

IUPAC3-[(1-acetylpiperidin-4-yl)methyl]-2-amino-5-methyl-5-[3-(3-methylphenyl)phenyl]imidazol-4-one;2-amino-3-butyl-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropylimidazol-4-one;2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(2-methylpropyl)imidazol-4-one;N-[(1R,3S)-3-[[(4R)-2-amino-4-(2-cyclohexylethyl)-1-methyl-5-oxoimidazol-4-yl]methyl]cyclohexyl]-6-methylpyridine-3-carboxamide;N-[3-(2-amino-1-methyl-5-oxo-4-phenylimidazol-4-yl)phenyl]pyridine-2-carboxamide
SMILESCC(=O)N1CCC(CN2C(=O)C(C)(c3cccc(-c4cccc(C)c4)c3)N=C2N)CC1.CC(C)CN1C(=O)C(c2cccc(-c3cccc(Cl)c3)c2)(C2CC2)N=C1N.CCCCN1C(=O)C(c2cccc(-c3cccc(Cl)c3)c2)(C2CC2)N=C1N.CN1C(=O)C(c2ccccc2)(c2cccc(NC(=O)c3ccccn3)c2)N=C1N.Cc1ccc(C(=O)N[C@@H]2CCC[C@H](C[C@@]3(CCC4CCCCC4)N=C(N)N(C)C3=O)C2)cn1
InChIInChI=1S/C26H39N5O2.C25H30N4O2.2C22H24ClN3O.C22H19N5O2/c1-18-11-12-21(17-28-18)23(32)29-22-10-6-9-20(15-22)16-26(24(33)31(2)25(27)30-26)14-13-19-7-4-3-5-8-19;1-17-6-4-7-20(14-17)21-8-5-9-22(15-21)25(3)23(31)29(24(26)27-25)16-19-10-12-28(13-11-19)18(2)30;1-14(2)13-26-20(27)22(17-9-10-17,25-21(26)24)18-7-3-5-15(11-18)16-6-4-8-19(23)12-16;1-2-3-12-26-20(27)22(17-10-11-17,25-21(26)24)18-8-4-6-15(13-18)16-7-5-9-19(23)14-16;1-27-20(29)22(26-21(27)23,15-8-3-2-4-9-15)16-10-7-11-17(14-16)25-19(28)18-12-5-6-13-24-18/h11-12,17,19-20,22H,3-10,13-16H2,1-2H3,(H2,27,30)(H,29,32);4-9,14-15,19H,10-13,16H2,1-3H3,(H2,26,27);3-8,11-12,14,17H,9-10,13H2,1-2H3,(H2,24,25);4-9,13-14,17H,2-3,10-12H2,1H3,(H2,24,25);2-14H,1H3,(H2,23,26)(H,25,28)/t20-,22+,26+;;;;/m0..../s1
InChIKeyHNUVWINKGSDGPY-MITDTIIXSA-N
MW2021.41 g/mol
LogP18.61
Rot. Bonds26

About 3-[(1-acetylpiperidin-4-yl)methyl]-2-amino-5-methyl-5-[3-(3-methylphenyl)phenyl]imidazol-4-one;2-amino-3-butyl-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropylimidazol-4-one;2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(2-methylpropyl)imidazol-4-one;N-[(1R,3S)-3-[[(4R)-2-amino-4-(2-cyclohexylethyl)-1-methyl-5-oxoimidazol-4-yl]methyl]cyclohexyl]-6-methylpyridine-3-carboxamide;N-[3-(2-amino-1-methyl-5-oxo-4-phenylimidazol-4-yl)phenyl]pyridine-2-carboxamide

3-[(1-acetylpiperidin-4-yl)methyl]-2-amino-5-methyl-5-[3-(3-methylphenyl)phenyl]imidazol-4-one;2-amino-3-butyl-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropylimidazol-4-one;2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(2-methylpropyl)imidazol-4-one;N-[(1R,3S)-3-[[(4R)-2-amino-4-(2-cyclohexylethyl)-1-methyl-5-oxoimidazol-4-yl]methyl]cyclohexyl]-6-methylpyridine-3-carboxamide;N-[3-(2-amino-1-methyl-5-oxo-4-phenylimidazol-4-yl)phenyl]pyridine-2-carboxamide (PubChem CID 158534855) has the molecular formula C117H136Cl2N20O8 and a molecular weight of 2021.41 g/mol. Its IUPAC name is 3-[(1-acetylpiperidin-4-yl)methyl]-2-amino-5-methyl-5-[3-(3-methylphenyl)phenyl]imidazol-4-one;2-amino-3-butyl-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropylimidazol-4-one;2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(2-methylpropyl)imidazol-4-one;N-[(1R,3S)-3-[[(4R)-2-amino-4-(2-cyclohexylethyl)-1-methyl-5-oxoimidazol-4-yl]methyl]cyclohexyl]-6-methylpyridine-3-carboxamide;N-[3-(2-amino-1-methyl-5-oxo-4-phenylimidazol-4-yl)phenyl]pyridine-2-carboxamide.

Molecular Properties

Compound Name3-[(1-acetylpiperidin-4-yl)methyl]-2-amino-5-methyl-5-[3-(3-methylphenyl)phenyl]imidazol-4-one;2-amino-3-butyl-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropylimidazol-4-one;2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(2-methylpropyl)imidazol-4-one;N-[(1R,3S)-3-[[(4R)-2-amino-4-(2-cyclohexylethyl)-1-methyl-5-oxoimidazol-4-yl]methyl]cyclohexyl]-6-methylpyridine-3-carboxamide;N-[3-(2-amino-1-methyl-5-oxo-4-phenylimidazol-4-yl)phenyl]pyridine-2-carboxamide
PubChem CID158534855
Molecular FormulaC117H136Cl2N20O8
Molecular Weight2021.41 g/mol
Exact Mass2019.02
IUPAC Name3-[(1-acetylpiperidin-4-yl)methyl]-2-amino-5-methyl-5-[3-(3-methylphenyl)phenyl]imidazol-4-one;2-amino-3-butyl-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropylimidazol-4-one;2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(2-methylpropyl)imidazol-4-one;N-[(1R,3S)-3-[[(4R)-2-amino-4-(2-cyclohexylethyl)-1-methyl-5-oxoimidazol-4-yl]methyl]cyclohexyl]-6-methylpyridine-3-carboxamide;N-[3-(2-amino-1-methyl-5-oxo-4-phenylimidazol-4-yl)phenyl]pyridine-2-carboxamide
SMILESCC(=O)N1CCC(CN2C(=O)C(C)(c3cccc(-c4cccc(C)c4)c3)N=C2N)CC1.CC(C)CN1C(=O)C(c2cccc(-c3cccc(Cl)c3)c2)(C2CC2)N=C1N.CCCCN1C(=O)C(c2cccc(-c3cccc(Cl)c3)c2)(C2CC2)N=C1N.CN1C(=O)C(c2ccccc2)(c2cccc(NC(=O)c3ccccn3)c2)N=C1N.Cc1ccc(C(=O)N[C@@H]2CCC[C@H](C[C@@]3(CCC4CCCCC4)N=C(N)N(C)C3=O)C2)cn1
InChIInChI=1S/C26H39N5O2.C25H30N4O2.2C22H24ClN3O.C22H19N5O2/c1-18-11-12-21(17-28-18)23(32)29-22-10-6-9-20(15-22)16-26(24(33)31(2)25(27)30-26)14-13-19-7-4-3-5-8-19;1-17-6-4-7-20(14-17)21-8-5-9-22(15-21)25(3)23(31)29(24(26)27-25)16-19-10-12-28(13-11-19)18(2)30;1-14(2)13-26-20(27)22(17-9-10-17,25-21(26)24)18-7-3-5-15(11-18)16-6-4-8-19(23)12-16;1-2-3-12-26-20(27)22(17-10-11-17,25-21(26)24)18-8-4-6-15(13-18)16-7-5-9-19(23)14-16;1-27-20(29)22(26-21(27)23,15-8-3-2-4-9-15)16-10-7-11-17(14-16)25-19(28)18-12-5-6-13-24-18/h11-12,17,19-20,22H,3-10,13-16H2,1-2H3,(H2,27,30)(H,29,32);4-9,14-15,19H,10-13,16H2,1-3H3,(H2,26,27);3-8,11-12,14,17H,9-10,13H2,1-2H3,(H2,24,25);4-9,13-14,17H,2-3,10-12H2,1H3,(H2,24,25);2-14H,1H3,(H2,23,26)(H,25,28)/t20-,22+,26+;;;;/m0..../s1
InChIKeyHNUVWINKGSDGPY-MITDTIIXSA-N
XLogP18.61
TPSA397.74 Ų
H-Bond Donors7
H-Bond Acceptors20
Rotatable Bonds26
Heavy Atoms147
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002021.41
LogP ≤ 518.61
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1020

Analyze 3-[(1-acetylpiperidin-4-yl)methyl]-2-amino-5-methyl-5-[3-(3-methylphenyl)phenyl]imidazol-4-one;2-amino-3-butyl-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropylimidazol-4-one;2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(2-methylpropyl)imidazol-4-one;N-[(1R,3S)-3-[[(4R)-2-amino-4-(2-cyclohexylethyl)-1-methyl-5-oxoimidazol-4-yl]methyl]cyclohexyl]-6-methylpyridine-3-carboxamide;N-[3-(2-amino-1-methyl-5-oxo-4-phenylimidazol-4-yl)phenyl]pyridine-2-carboxamide 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-amino-N-[1-[2-[3-[6-amino-5-[1-(8-chloro-1-oxo-2-phenylisoquinolin-3-yl)ethylcarbamoyl]-2-pyridinyl]phenyl]-8-chloro-1-oxoisoquinolin-3-yl]ethyl]-5-[3-[3-[1-[(6-aminopyridine-2-carbonyl)amino]ethyl]-8-chloro-1-oxoisoquinolin-2-yl]phenyl]pyrazine-2-carboxamide
CID 123918397
(5R)-2-amino-3-[[4-[[(4S)-4-butyl-2-oxoimidazolidin-1-yl]methyl]phenyl]methyl]-5-(2-cyclohexylethyl)-5-(cyclohexylmethyl)imidazol-4-one;2-amino-5-[3-(3-chlorophenyl)phenyl]-3,5-dimethylimidazol-4-one;N-[(1R,3S)-3-[[(4R)-2-amino-4-(2-cyclohexylethyl)-1-methyl-5-oxoimidazol-4-yl]methyl]cyclohexyl]-2-phenylacetamide;(5R)-2-amino-5-(2-cyclohexylethyl)-3-methyl-5-[[(1S,3R)-3-(pyridin-4-ylmethylamino)cyclohexyl]methyl]imidazol-4-one;(5R)-2-amino-5-(2-cyclohexylethyl)-3-methyl-5-[[(1S,3S)-3-(pyridin-4-ylmethylamino)cyclohexyl]methyl]imidazol-4-one
CID 157071394
2-amino-5-[3-(3-chlorophenyl)phenyl]-3,5-dimethylimidazol-4-one;3-[[(1R,3S)-3-[[(4R)-2-amino-4-(2-cyclohexylethyl)-1-methyl-5-oxoimidazol-4-yl]methyl]cyclohexyl]amino]-N-phenylpropanamide;(5R)-2-amino-5-(2-cyclohexylethyl)-3-methyl-5-[[(1S)-3-(pyridin-2-ylamino)cyclohexyl]methyl]imidazol-4-one;(5R)-2-amino-5-(2-cyclohexylethyl)-3-methyl-5-[[(1S,3R)-3-(pyridin-3-ylmethylamino)cyclohexyl]methyl]imidazol-4-one;(5R)-2-amino-5-(2-cyclohexylethyl)-3-methyl-5-[[(1S,3R)-3-(pyridin-4-ylmethylamino)cyclohexyl]methyl]imidazol-4-one;(5R)-2-amino-5-(2-cyclohexylethyl)-3-methyl-5-[[(1S,3S)-3-(pyridin-4-ylmethylamino)cyclohexyl]methyl]imidazol-4-one
CID 157135492
N-[2-(3-chlorophenyl)ethyl]-6-[4-(2-phenylcyclopropanecarbonyl)piperazin-1-yl]pyridine-3-carboxamide;N-(4-phenylbutan-2-yl)-6-[4-(2-phenylcyclopropanecarbonyl)piperazin-1-yl]pyridine-3-carboxamide
CID 157575569
3-[(1-acetylpiperidin-4-yl)methyl]-2-amino-5-[3-(3-chlorophenyl)phenyl]-5-methylimidazol-4-one;6-[[(1R,3S)-3-[[(4R)-2-amino-4-(2-cyclohexylethyl)-1-methyl-5-oxoimidazol-4-yl]methyl]cyclohexyl]amino]pyridine-3-carbonitrile;N-[(1R,3S)-3-[[(4R)-2-amino-4-(2-cyclohexylethyl)-1-methyl-5-oxoimidazol-4-yl]methyl]cyclohexyl]pyrazine-2-carboxamide;N-[(1R,3S)-3-[[(4R)-2-amino-4-(2-cyclohexylethyl)-1-methyl-5-oxoimidazol-4-yl]methyl]cyclohexyl]pyridine-3-carboxamide;N-[(1R,3S)-3-[[(4R)-2-amino-4-(2-cyclohexylethyl)-1-methyl-5-oxoimidazol-4-yl]methyl]cyclohexyl]pyrimidine-5-carboxamide
CID 157679439
(5R)-3-[(1-acetylpiperidin-4-yl)methyl]-2-amino-5-[3-(5-bromo-3-pyridinyl)phenyl]-5-cyclopropylimidazol-4-one;3-[[(3S)-1-acetylpiperidin-3-yl]methyl]-2-amino-5,5-diphenylimidazol-4-one;(5R)-2-amino-5-[3-(4-bromo-2-pyridinyl)phenyl]-5-cyclopropyl-3-methylimidazol-4-one;2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3H-pyrrol-4-one;2-amino-5,5-diphenyl-3-[[1-(piperidine-4-carbonyl)piperidin-4-yl]methyl]imidazol-4-one
CID 158306870
2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(pyridin-2-ylmethyl)imidazol-4-one;N-[(1R,3S)-3-[[(4R)-2-amino-4-(2-cyclohexylethyl)-1-methyl-5-oxoimidazol-4-yl]methyl]cyclohexyl]-1-oxidopyridin-1-ium-3-carboxamide;2-amino-5-cyclopropyl-3-methyl-5-(3-pyridin-3-ylphenyl)imidazol-4-one
CID 158687190
3-[(1-acetylpiperidin-4-yl)methyl]-2-amino-5-[3-(3,5-difluorophenyl)phenyl]-5-methylimidazol-4-one;2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(2-hydroxypropyl)imidazol-4-one;2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(3-hydroxypropyl)imidazol-4-one;(5R)-2-amino-5-(2-cyclohexylethyl)-3-methyl-5-[[(1S,3R)-3-(pyridin-3-ylamino)cyclohexyl]methyl]imidazol-4-one;2-amino-5,5-diphenyl-3-[[3-(pyrrolidine-1-carbonyl)phenyl]methyl]imidazol-4-one
CID 158708816
3-[(1-acetylpiperidin-4-yl)methyl]-2-amino-5-methyl-5-[3-(3-methylphenyl)phenyl]imidazol-4-one;2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(2-methylpropyl)imidazol-4-one;N-[3-(2-amino-1-methyl-5-oxo-4-phenylimidazol-4-yl)phenyl]pyridine-2-carboxamide
CID 158784803
2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-methylimidazol-4-one;2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(2-pyridin-2-ylethyl)imidazol-4-one;2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(2-pyridin-4-ylethyl)imidazol-4-one;2-amino-5-[3-(5-chloro-3-pyridinyl)phenyl]-5-cyclopropyl-3-methylimidazol-4-one;2-amino-5,5-diphenyl-3-[[1-(2-phenylacetyl)piperidin-4-yl]methyl]imidazol-4-one;N-[(1R,3S)-3-[[(4R)-2-amino-1-methyl-5-oxo-4-(2-phenylethyl)imidazol-4-yl]methyl]cyclohexyl]-3-chlorobenzamide
CID 159196376
2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(thiophen-2-ylmethyl)imidazol-4-one;N-[(1R,3S)-3-[[(4R)-2-amino-4-(2-cyclohexylethyl)-1-methyl-5-oxoimidazol-4-yl]methyl]cyclohexyl]-6-fluoropyridine-3-carboxamide;2-amino-5-cyclopropyl-3-methyl-5-[3-(5-methyl-3-pyridinyl)phenyl]imidazol-4-one
CID 159478898
N-[(1R,3S)-3-[[(4R)-2-amino-4-(2-cyclohexylethyl)-1-methyl-5-oxoimidazol-4-yl]methyl]cyclohexyl]-2-chloro-3-fluoropyridine-4-carboxamide;N-[3-[3-(2-amino-3,5-dimethyl-4H-imidazol-5-yl)phenyl]phenyl]acetamide;1-[3-[3-(2-amino-3,5-dimethyl-4H-imidazol-5-yl)phenyl]phenyl]ethanone;2-amino-5,5-diphenyl-3-[[1-[(1R,2R)-2-phenylcyclopropanecarbonyl]piperidin-4-yl]methyl]imidazol-4-one
CID 159479271

Frequently Asked Questions

What is the IUPAC name of 3-[(1-acetylpiperidin-4-yl)methyl]-2-amino-5-methyl-5-[3-(3-methylphenyl)phenyl]imidazol-4-one;2-amino-3-butyl-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropylimidazol-4-one;2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(2-methylpropyl)imidazol-4-one;N-[(1R,3S)-3-[[(4R)-2-amino-4-(2-cyclohexylethyl)-1-methyl-5-oxoimidazol-4-yl]methyl]cyclohexyl]-6-methylpyridine-3-carboxamide;N-[3-(2-amino-1-methyl-5-oxo-4-phenylimidazol-4-yl)phenyl]pyridine-2-carboxamide?
The IUPAC name of 3-[(1-acetylpiperidin-4-yl)methyl]-2-amino-5-methyl-5-[3-(3-methylphenyl)phenyl]imidazol-4-one;2-amino-3-butyl-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropylimidazol-4-one;2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(2-methylpropyl)imidazol-4-one;N-[(1R,3S)-3-[[(4R)-2-amino-4-(2-cyclohexylethyl)-1-methyl-5-oxoimidazol-4-yl]methyl]cyclohexyl]-6-methylpyridine-3-carboxamide;N-[3-(2-amino-1-methyl-5-oxo-4-phenylimidazol-4-yl)phenyl]pyridine-2-carboxamide (CID 158534855) is 3-[(1-acetylpiperidin-4-yl)methyl]-2-amino-5-methyl-5-[3-(3-methylphenyl)phenyl]imidazol-4-one;2-amino-3-butyl-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropylimidazol-4-one;2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(2-methylpropyl)imidazol-4-one;N-[(1R,3S)-3-[[(4R)-2-amino-4-(2-cyclohexylethyl)-1-methyl-5-oxoimidazol-4-yl]methyl]cyclohexyl]-6-methylpyridine-3-carboxamide;N-[3-(2-amino-1-methyl-5-oxo-4-phenylimidazol-4-yl)phenyl]pyridine-2-carboxamide.
What is the SMILES notation for 3-[(1-acetylpiperidin-4-yl)methyl]-2-amino-5-methyl-5-[3-(3-methylphenyl)phenyl]imidazol-4-one;2-amino-3-butyl-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropylimidazol-4-one;2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(2-methylpropyl)imidazol-4-one;N-[(1R,3S)-3-[[(4R)-2-amino-4-(2-cyclohexylethyl)-1-methyl-5-oxoimidazol-4-yl]methyl]cyclohexyl]-6-methylpyridine-3-carboxamide;N-[3-(2-amino-1-methyl-5-oxo-4-phenylimidazol-4-yl)phenyl]pyridine-2-carboxamide?
The canonical SMILES for 3-[(1-acetylpiperidin-4-yl)methyl]-2-amino-5-methyl-5-[3-(3-methylphenyl)phenyl]imidazol-4-one;2-amino-3-butyl-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropylimidazol-4-one;2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(2-methylpropyl)imidazol-4-one;N-[(1R,3S)-3-[[(4R)-2-amino-4-(2-cyclohexylethyl)-1-methyl-5-oxoimidazol-4-yl]methyl]cyclohexyl]-6-methylpyridine-3-carboxamide;N-[3-(2-amino-1-methyl-5-oxo-4-phenylimidazol-4-yl)phenyl]pyridine-2-carboxamide is CC(=O)N1CCC(CN2C(=O)C(C)(c3cccc(-c4cccc(C)c4)c3)N=C2N)CC1.CC(C)CN1C(=O)C(c2cccc(-c3cccc(Cl)c3)c2)(C2CC2)N=C1N.CCCCN1C(=O)C(c2cccc(-c3cccc(Cl)c3)c2)(C2CC2)N=C1N.CN1C(=O)C(c2ccccc2)(c2cccc(NC(=O)c3ccccn3)c2)N=C1N.Cc1ccc(C(=O)N[C@@H]2CCC[C@H](C[C@@]3(CCC4CCCCC4)N=C(N)N(C)C3=O)C2)cn1.
What is the InChIKey of 3-[(1-acetylpiperidin-4-yl)methyl]-2-amino-5-methyl-5-[3-(3-methylphenyl)phenyl]imidazol-4-one;2-amino-3-butyl-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropylimidazol-4-one;2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(2-methylpropyl)imidazol-4-one;N-[(1R,3S)-3-[[(4R)-2-amino-4-(2-cyclohexylethyl)-1-methyl-5-oxoimidazol-4-yl]methyl]cyclohexyl]-6-methylpyridine-3-carboxamide;N-[3-(2-amino-1-methyl-5-oxo-4-phenylimidazol-4-yl)phenyl]pyridine-2-carboxamide?
The InChIKey is HNUVWINKGSDGPY-MITDTIIXSA-N. The full InChI is InChI=1S/C26H39N5O2.C25H30N4O2.2C22H24ClN3O.C22H19N5O2/c1-18-11-12-21(17-28-18)23(32)29-22-10-6-9-20(15-22)16-26(24(33)31(2)25(27)30-26)14-13-19-7-4-3-5-8-19;1-17-6-4-7-20(14-17)21-8-5-9-22(15-21)25(3)23(31)29(24(26)27-25)16-19-10-12-28(13-11-19)18(2)30;1-14(2)13-26-20(27)22(17-9-10-17,25-21(26)24)18-7-3-5-15(11-18)16-6-4-8-19(23)12-16;1-2-3-12-26-20(27)22(17-10-11-17,25-21(26)24)18-8-4-6-15(13-18)16-7-5-9-19(23)14-16;1-27-20(29)22(26-21(27)23,15-8-3-2-4-9-15)16-10-7-11-17(14-16)25-19(28)18-12-5-6-13-24-18/h11-12,17,19-20,22H,3-10,13-16H2,1-2H3,(H2,27,30)(H,29,32);4-9,14-15,19H,10-13,16H2,1-3H3,(H2,26,27);3-8,11-12,14,17H,9-10,13H2,1-2H3,(H2,24,25);4-9,13-14,17H,2-3,10-12H2,1H3,(H2,24,25);2-14H,1H3,(H2,23,26)(H,25,28)/t20-,22+,26+;;;;/m0..../s1.
What are the key properties of 3-[(1-acetylpiperidin-4-yl)methyl]-2-amino-5-methyl-5-[3-(3-methylphenyl)phenyl]imidazol-4-one;2-amino-3-butyl-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropylimidazol-4-one;2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(2-methylpropyl)imidazol-4-one;N-[(1R,3S)-3-[[(4R)-2-amino-4-(2-cyclohexylethyl)-1-methyl-5-oxoimidazol-4-yl]methyl]cyclohexyl]-6-methylpyridine-3-carboxamide;N-[3-(2-amino-1-methyl-5-oxo-4-phenylimidazol-4-yl)phenyl]pyridine-2-carboxamide?
3-[(1-acetylpiperidin-4-yl)methyl]-2-amino-5-methyl-5-[3-(3-methylphenyl)phenyl]imidazol-4-one;2-amino-3-butyl-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropylimidazol-4-one;2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(2-methylpropyl)imidazol-4-one;N-[(1R,3S)-3-[[(4R)-2-amino-4-(2-cyclohexylethyl)-1-methyl-5-oxoimidazol-4-yl]methyl]cyclohexyl]-6-methylpyridine-3-carboxamide;N-[3-(2-amino-1-methyl-5-oxo-4-phenylimidazol-4-yl)phenyl]pyridine-2-carboxamide has a molecular weight of 2021.41 g/mol, XLogP of 18.61, 26 rotatable bonds, 7 hydrogen bond donors, and 20 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(1-acetylpiperidin-4-yl)methyl]-2-amino-5-methyl-5-[3-(3-methylphenyl)phenyl]imidazol-4-one;2-amino-3-butyl-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropylimidazol-4-one;2-amino-5-[3-(3-chlorophenyl)phenyl]-5-cyclopropyl-3-(2-methylpropyl)imidazol-4-one;N-[(1R,3S)-3-[[(4R)-2-amino-4-(2-cyclohexylethyl)-1-methyl-5-oxoimidazol-4-yl]methyl]cyclohexyl]-6-methylpyridine-3-carboxamide;N-[3-(2-amino-1-methyl-5-oxo-4-phenylimidazol-4-yl)phenyl]pyridine-2-carboxamide is sourced from PubChem (CID 158534855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).