N-[(6-amino-2,4-dimethyl-3-pyridinyl)methyl]-1-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]imidazole-4-carboxamide;tert-butyl N-[4,6-dimethyl-5-[[[1-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]imidazole-4-carbonyl]amino]methyl]-2-pyridinyl]carbamate;methane;methyl (Z)-3-(dimethylamino)-2-isocyanoprop-2-enoate;methyl 1-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]imidazole-4-carboxylate;[4-(pyrazol-1-ylmethyl)phenyl]methanamine;1-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]imidazole-4-carboxylic acid

C101H115N27O10 — CID 157211507

IUPACN-[(6-amino-2,4-dimethyl-3-pyridinyl)methyl]-1-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]imidazole-4-carboxamide;tert-butyl N-[4,6-dimethyl-5-[[[1-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]imidazole-4-carbonyl]amino]methyl]-2-pyridinyl]carbamate;methane;methyl (Z)-3-(dimethylamino)-2-isocyanoprop-2-enoate;methyl 1-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]imidazole-4-carboxylate;[4-(pyrazol-1-ylmethyl)phenyl]methanamine;1-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]imidazole-4-carboxylic acid
SMILESC.COC(=O)c1cn(Cc2ccc(Cn3cccn3)cc2)cn1.Cc1cc(N)nc(C)c1CNC(=O)c1cn(Cc2ccc(Cn3cccn3)cc2)cn1.Cc1cc(NC(=O)OC(C)(C)C)nc(C)c1CNC(=O)c1cn(Cc2ccc(Cn3cccn3)cc2)cn1.NCc1ccc(Cn2cccn2)cc1.O=C(O)c1cn(Cc2ccc(Cn3cccn3)cc2)cn1.[C-]#[N+]/C(=C\N(C)C)C(=O)OC
InChIInChI=1S/C28H33N7O3.C23H25N7O.C16H16N4O2.C15H14N4O2.C11H13N3.C7H10N2O2.CH4/c1-19-13-25(33-27(37)38-28(3,4)5)32-20(2)23(19)14-29-26(36)24-17-34(18-30-24)15-21-7-9-22(10-8-21)16-35-12-6-11-31-35;1-16-10-22(24)28-17(2)20(16)11-25-23(31)21-14-29(15-26-21)12-18-4-6-19(7-5-18)13-30-9-3-8-27-30;1-22-16(21)15-11-19(12-17-15)9-13-3-5-14(6-4-13)10-20-8-2-7-18-20;20-15(21)14-10-18(11-16-14)8-12-2-4-13(5-3-12)9-19-7-1-6-17-19;12-8-10-2-4-11(5-3-10)9-14-7-1-6-13-14;1-8-6(5-9(2)3)7(10)11-4;/h6-13,17-18H,14-16H2,1-5H3,(H,29,36)(H,32,33,37);3-10,14-15H,11-13H2,1-2H3,(H2,24,28)(H,25,31);2-8,11-12H,9-10H2,1H3;1-7,10-11H,8-9H2,(H,20,21);1-7H,8-9,12H2;5H,2-4H3;1H4/b;;;;;6-5-;
InChIKeyARYCSEBMEVWXLZ-PBLUIJAZSA-N
MW1867.21 g/mol
LogP13.51
Rot. Bonds30

About N-[(6-amino-2,4-dimethyl-3-pyridinyl)methyl]-1-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]imidazole-4-carboxamide;tert-butyl N-[4,6-dimethyl-5-[[[1-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]imidazole-4-carbonyl]amino]methyl]-2-pyridinyl]carbamate;methane;methyl (Z)-3-(dimethylamino)-2-isocyanoprop-2-enoate;methyl 1-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]imidazole-4-carboxylate;[4-(pyrazol-1-ylmethyl)phenyl]methanamine;1-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]imidazole-4-carboxylic acid

N-[(6-amino-2,4-dimethyl-3-pyridinyl)methyl]-1-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]imidazole-4-carboxamide;tert-butyl N-[4,6-dimethyl-5-[[[1-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]imidazole-4-carbonyl]amino]methyl]-2-pyridinyl]carbamate;methane;methyl (Z)-3-(dimethylamino)-2-isocyanoprop-2-enoate;methyl 1-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]imidazole-4-carboxylate;[4-(pyrazol-1-ylmethyl)phenyl]methanamine;1-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]imidazole-4-carboxylic acid (PubChem CID 157211507) has the molecular formula C101H115N27O10 and a molecular weight of 1867.21 g/mol. Its IUPAC name is N-[(6-amino-2,4-dimethyl-3-pyridinyl)methyl]-1-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]imidazole-4-carboxamide;tert-butyl N-[4,6-dimethyl-5-[[[1-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]imidazole-4-carbonyl]amino]methyl]-2-pyridinyl]carbamate;methane;methyl (Z)-3-(dimethylamino)-2-isocyanoprop-2-enoate;methyl 1-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]imidazole-4-carboxylate;[4-(pyrazol-1-ylmethyl)phenyl]methanamine;1-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]imidazole-4-carboxylic acid.

Molecular Properties

Compound NameN-[(6-amino-2,4-dimethyl-3-pyridinyl)methyl]-1-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]imidazole-4-carboxamide;tert-butyl N-[4,6-dimethyl-5-[[[1-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]imidazole-4-carbonyl]amino]methyl]-2-pyridinyl]carbamate;methane;methyl (Z)-3-(dimethylamino)-2-isocyanoprop-2-enoate;methyl 1-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]imidazole-4-carboxylate;[4-(pyrazol-1-ylmethyl)phenyl]methanamine;1-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]imidazole-4-carboxylic acid
PubChem CID157211507
Molecular FormulaC101H115N27O10
Molecular Weight1867.21 g/mol
Exact Mass1865.93
IUPAC NameN-[(6-amino-2,4-dimethyl-3-pyridinyl)methyl]-1-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]imidazole-4-carboxamide;tert-butyl N-[4,6-dimethyl-5-[[[1-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]imidazole-4-carbonyl]amino]methyl]-2-pyridinyl]carbamate;methane;methyl (Z)-3-(dimethylamino)-2-isocyanoprop-2-enoate;methyl 1-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]imidazole-4-carboxylate;[4-(pyrazol-1-ylmethyl)phenyl]methanamine;1-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]imidazole-4-carboxylic acid
SMILESC.COC(=O)c1cn(Cc2ccc(Cn3cccn3)cc2)cn1.Cc1cc(N)nc(C)c1CNC(=O)c1cn(Cc2ccc(Cn3cccn3)cc2)cn1.Cc1cc(NC(=O)OC(C)(C)C)nc(C)c1CNC(=O)c1cn(Cc2ccc(Cn3cccn3)cc2)cn1.NCc1ccc(Cn2cccn2)cc1.O=C(O)c1cn(Cc2ccc(Cn3cccn3)cc2)cn1.[C-]#[N+]/C(=C\N(C)C)C(=O)OC
InChIInChI=1S/C28H33N7O3.C23H25N7O.C16H16N4O2.C15H14N4O2.C11H13N3.C7H10N2O2.CH4/c1-19-13-25(33-27(37)38-28(3,4)5)32-20(2)23(19)14-29-26(36)24-17-34(18-30-24)15-21-7-9-22(10-8-21)16-35-12-6-11-31-35;1-16-10-22(24)28-17(2)20(16)11-25-23(31)21-14-29(15-26-21)12-18-4-6-19(7-5-18)13-30-9-3-8-27-30;1-22-16(21)15-11-19(12-17-15)9-13-3-5-14(6-4-13)10-20-8-2-7-18-20;20-15(21)14-10-18(11-16-14)8-12-2-4-13(5-3-12)9-19-7-1-6-17-19;12-8-10-2-4-11(5-3-10)9-14-7-1-6-13-14;1-8-6(5-9(2)3)7(10)11-4;/h6-13,17-18H,14-16H2,1-5H3,(H,29,36)(H,32,33,37);3-10,14-15H,11-13H2,1-2H3,(H2,24,28)(H,25,31);2-8,11-12H,9-10H2,1H3;1-7,10-11H,8-9H2,(H,20,21);1-7H,8-9,12H2;5H,2-4H3;1H4/b;;;;;6-5-;
InChIKeyARYCSEBMEVWXLZ-PBLUIJAZSA-N
XLogP13.51
TPSA432.23 Ų
H-Bond Donors6
H-Bond Acceptors32
Rotatable Bonds30
Heavy Atoms138
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001867.21
LogP ≤ 513.51
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1032

Computed Properties (RDKit)

Structural Alerts{'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

Analyze N-[(6-amino-2,4-dimethyl-3-pyridinyl)methyl]-1-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]imidazole-4-carboxamide;tert-butyl N-[4,6-dimethyl-5-[[[1-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]imidazole-4-carbonyl]amino]methyl]-2-pyridinyl]carbamate;methane;methyl (Z)-3-(dimethylamino)-2-isocyanoprop-2-enoate;methyl 1-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]imidazole-4-carboxylate;[4-(pyrazol-1-ylmethyl)phenyl]methanamine;1-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]imidazole-4-carboxylic acid with MolForge

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Related Compounds

tert-butyl 4-[[1-[2-[[(1S)-1-phenylethyl]amino]pyrimidin-4-yl]-2-[3-(trifluoromethyl)phenyl]imidazole-4-carbonyl]amino]piperidine-1-carboxylate;ethyl 1-[2-[[(1S)-1-phenylethyl]amino]pyrimidin-4-yl]-2-[3-(trifluoromethyl)phenyl]imidazole-4-carboxylate;1-[2-[[(1S)-1-phenylethyl]amino]pyrimidin-4-yl]-N-piperidin-4-yl-2-[3-(trifluoromethyl)phenyl]imidazole-4-carboxamide;1-[2-[[(1S)-1-phenylethyl]amino]pyrimidin-4-yl]-2-[3-(trifluoromethyl)phenyl]imidazole-4-carboxylic acid
CID 157726574
[3-Ethyl-2,6-dioxo-1-propyl-8-[1-[[3-(trifluoromethyl)phenyl]methyl]pyrazol-4-yl]purin-7-yl]methyl 1-methylimidazole-2-carboxylate;[3-ethyl-2,6-dioxo-1-propyl-8-[1-[[3-(trifluoromethyl)phenyl]methyl]pyrazol-4-yl]purin-7-yl]methyl 1-methylimidazole-4-carboxylate
CID 160134098
tert-butyl 4-[[1-[2-[[(1S)-1-phenylethyl]amino]pyrimidin-4-yl]-2-[3-(trifluoromethyl)phenyl]imidazole-4-carbonyl]amino]piperidine-1-carboxylate;ethyl 1-[2-[[(1S)-1-phenylethyl]amino]pyrimidin-4-yl]-2-[3-(trifluoromethyl)phenyl]imidazole-4-carboxylate;1-[2-[[(1S)-1-phenylethyl]amino]pyrimidin-4-yl]-2-[3-(trifluoromethyl)phenyl]imidazole-4-carboxylic acid;[1-[2-[[(1S)-1-phenylethyl]amino]pyrimidin-4-yl]-2-[3-(trifluoromethyl)phenyl]imidazol-4-yl]-piperazin-1-ylmethanone
CID 160157505
3-amino-6-(3-methylbenzimidazol-5-yl)-N-[[(2R)-1-methylpyrrolidin-2-yl]methyl]-5-(triazol-2-yl)pyrazine-2-carboxamide;3-amino-6-(3-methylbenzimidazol-5-yl)-5-(triazol-2-yl)pyrazine-2-carboxylic acid;methyl 3-amino-6-chloro-5-(triazol-2-yl)pyrazine-2-carboxylate;[(2R)-1-methylpyrrolidin-2-yl]methanamine;1-methyl-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzimidazole
CID 157092984
2-[4-[3-[2-[4-(2-aminopyrimidin-5-yl)phenyl]-3-methylbutan-2-yl]-1,2,4-oxadiazol-5-yl]piperazin-1-yl]acetic acid;5-[4-[(1R)-1-cyclopropyl-1-[5-(1-cyclopropylpyrazol-4-yl)-1,2,4-oxadiazol-3-yl]ethyl]phenyl]pyrimidin-2-amine;5-[4-[(2R)-2-[5-[5-(2-methoxyethylamino)pyrazin-2-yl]-1,2,4-oxadiazol-3-yl]-3-methylbutan-2-yl]phenyl]pyrimidin-2-amine;5-[4-[(2S)-2-[5-[5-(2-methoxyethylamino)pyrazin-2-yl]-1,2,4-oxadiazol-3-yl]-3-methylbutan-2-yl]phenyl]pyrimidin-2-amine
CID 157164971
tert-butyl N-(3-phenylimidazol-4-yl)carbamate;methane;2-methylpropan-2-ol;bis(3-phenylimidazol-4-amine);3-phenylimidazole-4-carbonyl azide;3-phenylimidazole-4-carboxylic acid
CID 157794231
6-bromoimidazo[1,2-a]pyridine-2-carboxylic acid;tert-butyl 3-[[(6-bromoimidazo[1,2-a]pyridine-2-carbonyl)amino]methyl]pyrrolidine-1-carboxylate;tert-butyl 3-[[[6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridine-2-carbonyl]amino]methyl]pyrrolidine-1-carboxylate;N-[(1-cyanopyrrolidin-3-yl)methyl]-6-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridine-2-carboxamide
CID 157940004
1-[4-[3-[1-[4-(6-Amino-3-pyridinyl)phenyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]-2-methylpropan-2-ol;1-[[5-[3-[1-[4-(2-aminopyrimidin-5-yl)phenyl]cyclobutyl]-1,2,4-oxadiazol-5-yl]pyrazin-2-yl]amino]propan-2-ol;5-[4-[1-[5-[5-[2-methoxyethyl(methyl)amino]pyrazin-2-yl]-1,2,4-oxadiazol-3-yl]cyclobutyl]phenyl]pyrimidin-2-amine;5-[4-[1-[5-[1-(oxetan-3-yl)pyrazol-4-yl]-1,2,4-oxadiazol-3-yl]cyclobutyl]phenyl]pyrazin-2-amine
CID 158192565
3-Amino-2-(4-methylphenyl)imidazole-4-carboxylic acid;bis(tert-butyl 4-(aminomethyl)-4-hydroxypiperidine-1-carboxylate);tert-butyl 4-[[[3-amino-2-(4-methylphenyl)imidazole-4-carbonyl]amino]methyl]-4-hydroxypiperidine-1-carboxylate;tert-butyl 1-oxa-6-azaspiro[2.5]octane-6-carboxylate;3-[(4-hydroxypiperidin-4-yl)methyl]-7-(4-methylphenyl)imidazo[5,1-f][1,2,4]triazin-4-one;3-[[4-hydroxy-1-(3-pyrazol-1-ylbutanoyl)piperidin-4-yl]methyl]-7-(4-methylphenyl)imidazo[5,1-f][1,2,4]triazin-4-one;3-pyrazol-1-ylbutanoic acid
CID 158711448
1-(azidomethyl)-4-phenylbenzene;1-(bromomethyl)-4-phenylbenzene;tert-butyl N-[4,6-dimethyl-5-[[[1-[(4-phenylphenyl)methyl]triazole-4-carbonyl]amino]methyl]-2-pyridinyl]carbamate;methane;methyl 1-[(4-phenylphenyl)methyl]triazole-4-carboxylate;methyl prop-2-ynoate;1-[(4-phenylphenyl)methyl]triazole-4-carboxylic acid
CID 158754163
5-[4-[2-[5-(4-aminopiperidin-1-yl)-1,2,4-oxadiazol-3-yl]-3-methylbutan-2-yl]phenyl]pyrimidin-2-amine;2-[4-[3-[(1R)-1-[4-(2-aminopyrimidin-5-yl)phenyl]-1-cyclopropylethyl]-1,2,4-oxadiazol-5-yl]pyrazol-1-yl]-1-[(3S)-3-methoxypyrrolidin-1-yl]ethanone;1-[[5-[3-[2-[4-(2-aminopyrimidin-5-yl)phenyl]propan-2-yl]-1,2,4-oxadiazol-5-yl]pyrazin-2-yl]amino]-2-methylpropan-2-ol;2-[[5-[3-[2-[4-(2-aminopyrimidin-5-yl)phenyl]propan-2-yl]-1,2,4-oxadiazol-5-yl]pyrazin-2-yl]amino]-2-methylpropan-1-ol
CID 158880661
3-amino-2,2-dimethylpropan-1-ol;7-[benzyl(methyl)amino]-N-(3-hydroxy-2,2-dimethylpropyl)-5-[1-(2-morpholin-4-ylethyl)pyrrolo[2,3-b]pyridin-3-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;N-(3-hydroxy-2,2-dimethylpropyl)-7-(methylamino)-5-[1-(2-morpholin-4-ylethyl)pyrrolo[2,3-b]pyridin-3-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;7-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-5-[1-(2-morpholin-4-ylethyl)pyrrolo[2,3-b]pyridin-3-yl]pyrazolo[1,5-a]pyrimidine-3-carboxylic acid
CID 159627367

Frequently Asked Questions

What is the IUPAC name of N-[(6-amino-2,4-dimethyl-3-pyridinyl)methyl]-1-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]imidazole-4-carboxamide;tert-butyl N-[4,6-dimethyl-5-[[[1-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]imidazole-4-carbonyl]amino]methyl]-2-pyridinyl]carbamate;methane;methyl (Z)-3-(dimethylamino)-2-isocyanoprop-2-enoate;methyl 1-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]imidazole-4-carboxylate;[4-(pyrazol-1-ylmethyl)phenyl]methanamine;1-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]imidazole-4-carboxylic acid?
The IUPAC name of N-[(6-amino-2,4-dimethyl-3-pyridinyl)methyl]-1-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]imidazole-4-carboxamide;tert-butyl N-[4,6-dimethyl-5-[[[1-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]imidazole-4-carbonyl]amino]methyl]-2-pyridinyl]carbamate;methane;methyl (Z)-3-(dimethylamino)-2-isocyanoprop-2-enoate;methyl 1-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]imidazole-4-carboxylate;[4-(pyrazol-1-ylmethyl)phenyl]methanamine;1-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]imidazole-4-carboxylic acid (CID 157211507) is N-[(6-amino-2,4-dimethyl-3-pyridinyl)methyl]-1-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]imidazole-4-carboxamide;tert-butyl N-[4,6-dimethyl-5-[[[1-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]imidazole-4-carbonyl]amino]methyl]-2-pyridinyl]carbamate;methane;methyl (Z)-3-(dimethylamino)-2-isocyanoprop-2-enoate;methyl 1-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]imidazole-4-carboxylate;[4-(pyrazol-1-ylmethyl)phenyl]methanamine;1-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]imidazole-4-carboxylic acid.
What is the SMILES notation for N-[(6-amino-2,4-dimethyl-3-pyridinyl)methyl]-1-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]imidazole-4-carboxamide;tert-butyl N-[4,6-dimethyl-5-[[[1-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]imidazole-4-carbonyl]amino]methyl]-2-pyridinyl]carbamate;methane;methyl (Z)-3-(dimethylamino)-2-isocyanoprop-2-enoate;methyl 1-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]imidazole-4-carboxylate;[4-(pyrazol-1-ylmethyl)phenyl]methanamine;1-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]imidazole-4-carboxylic acid?
The canonical SMILES for N-[(6-amino-2,4-dimethyl-3-pyridinyl)methyl]-1-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]imidazole-4-carboxamide;tert-butyl N-[4,6-dimethyl-5-[[[1-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]imidazole-4-carbonyl]amino]methyl]-2-pyridinyl]carbamate;methane;methyl (Z)-3-(dimethylamino)-2-isocyanoprop-2-enoate;methyl 1-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]imidazole-4-carboxylate;[4-(pyrazol-1-ylmethyl)phenyl]methanamine;1-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]imidazole-4-carboxylic acid is C.COC(=O)c1cn(Cc2ccc(Cn3cccn3)cc2)cn1.Cc1cc(N)nc(C)c1CNC(=O)c1cn(Cc2ccc(Cn3cccn3)cc2)cn1.Cc1cc(NC(=O)OC(C)(C)C)nc(C)c1CNC(=O)c1cn(Cc2ccc(Cn3cccn3)cc2)cn1.NCc1ccc(Cn2cccn2)cc1.O=C(O)c1cn(Cc2ccc(Cn3cccn3)cc2)cn1.[C-]#[N+]/C(=C\N(C)C)C(=O)OC.
What is the InChIKey of N-[(6-amino-2,4-dimethyl-3-pyridinyl)methyl]-1-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]imidazole-4-carboxamide;tert-butyl N-[4,6-dimethyl-5-[[[1-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]imidazole-4-carbonyl]amino]methyl]-2-pyridinyl]carbamate;methane;methyl (Z)-3-(dimethylamino)-2-isocyanoprop-2-enoate;methyl 1-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]imidazole-4-carboxylate;[4-(pyrazol-1-ylmethyl)phenyl]methanamine;1-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]imidazole-4-carboxylic acid?
The InChIKey is ARYCSEBMEVWXLZ-PBLUIJAZSA-N. The full InChI is InChI=1S/C28H33N7O3.C23H25N7O.C16H16N4O2.C15H14N4O2.C11H13N3.C7H10N2O2.CH4/c1-19-13-25(33-27(37)38-28(3,4)5)32-20(2)23(19)14-29-26(36)24-17-34(18-30-24)15-21-7-9-22(10-8-21)16-35-12-6-11-31-35;1-16-10-22(24)28-17(2)20(16)11-25-23(31)21-14-29(15-26-21)12-18-4-6-19(7-5-18)13-30-9-3-8-27-30;1-22-16(21)15-11-19(12-17-15)9-13-3-5-14(6-4-13)10-20-8-2-7-18-20;20-15(21)14-10-18(11-16-14)8-12-2-4-13(5-3-12)9-19-7-1-6-17-19;12-8-10-2-4-11(5-3-10)9-14-7-1-6-13-14;1-8-6(5-9(2)3)7(10)11-4;/h6-13,17-18H,14-16H2,1-5H3,(H,29,36)(H,32,33,37);3-10,14-15H,11-13H2,1-2H3,(H2,24,28)(H,25,31);2-8,11-12H,9-10H2,1H3;1-7,10-11H,8-9H2,(H,20,21);1-7H,8-9,12H2;5H,2-4H3;1H4/b;;;;;6-5-;.
What are the key properties of N-[(6-amino-2,4-dimethyl-3-pyridinyl)methyl]-1-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]imidazole-4-carboxamide;tert-butyl N-[4,6-dimethyl-5-[[[1-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]imidazole-4-carbonyl]amino]methyl]-2-pyridinyl]carbamate;methane;methyl (Z)-3-(dimethylamino)-2-isocyanoprop-2-enoate;methyl 1-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]imidazole-4-carboxylate;[4-(pyrazol-1-ylmethyl)phenyl]methanamine;1-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]imidazole-4-carboxylic acid?
N-[(6-amino-2,4-dimethyl-3-pyridinyl)methyl]-1-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]imidazole-4-carboxamide;tert-butyl N-[4,6-dimethyl-5-[[[1-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]imidazole-4-carbonyl]amino]methyl]-2-pyridinyl]carbamate;methane;methyl (Z)-3-(dimethylamino)-2-isocyanoprop-2-enoate;methyl 1-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]imidazole-4-carboxylate;[4-(pyrazol-1-ylmethyl)phenyl]methanamine;1-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]imidazole-4-carboxylic acid has a molecular weight of 1867.21 g/mol, XLogP of 13.51, 30 rotatable bonds, 6 hydrogen bond donors, and 32 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(6-amino-2,4-dimethyl-3-pyridinyl)methyl]-1-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]imidazole-4-carboxamide;tert-butyl N-[4,6-dimethyl-5-[[[1-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]imidazole-4-carbonyl]amino]methyl]-2-pyridinyl]carbamate;methane;methyl (Z)-3-(dimethylamino)-2-isocyanoprop-2-enoate;methyl 1-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]imidazole-4-carboxylate;[4-(pyrazol-1-ylmethyl)phenyl]methanamine;1-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]imidazole-4-carboxylic acid is sourced from PubChem (CID 157211507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).