N-[3-[(5-tert-butylfuran-2-carbonyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[(5-ethylfuran-2-carbonyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[(5-methylfuran-2-carbonyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[(1-methylimidazole-4-carbonyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;6-methyl-N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]pyrazine-2-carboxamide;N-[3-(oxane-2-carbonylamino)propyl]-3-phenyl-1H-pyrazole-5-carboxamide;3-phenyl-N-[3-[(3-phenylfuran-2-carbonyl)amino]propyl]-1H-pyrazole-5-carboxamide;3-phenyl-N-[3-(1H-pyrazole-5-carbonylamino)propyl]-1H-pyrazole-5-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-6-(trifluoromethyl)pyridine-2-carboxamide

C178H190F3N43O23 — CID 159066435

IUPACN-[3-[(5-tert-butylfuran-2-carbonyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[(5-ethylfuran-2-carbonyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[(5-methylfuran-2-carbonyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[(1-methylimidazole-4-carbonyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;6-methyl-N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]pyrazine-2-carboxamide;N-[3-(oxane-2-carbonylamino)propyl]-3-phenyl-1H-pyrazole-5-carboxamide;3-phenyl-N-[3-[(3-phenylfuran-2-carbonyl)amino]propyl]-1H-pyrazole-5-carboxamide;3-phenyl-N-[3-(1H-pyrazole-5-carbonylamino)propyl]-1H-pyrazole-5-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-6-(trifluoromethyl)pyridine-2-carboxamide
SMILESCC(C)(C)c1ccc(C(=O)NCCCNC(=O)c2cc(-c3ccccc3)n[nH]2)o1.CCc1ccc(C(=O)NCCCNC(=O)c2cc(-c3ccccc3)n[nH]2)o1.Cc1ccc(C(=O)NCCCNC(=O)c2cc(-c3ccccc3)n[nH]2)o1.Cc1cncc(C(=O)NCCCNC(=O)c2cc(-c3ccccc3)n[nH]2)n1.Cn1cnc(C(=O)NCCCNC(=O)c2cc(-c3ccccc3)n[nH]2)c1.O=C(NCCCNC(=O)C1CCCCO1)c1cc(-c2ccccc2)n[nH]1.O=C(NCCCNC(=O)c1cc(-c2ccccc2)n[nH]1)c1cccc(C(F)(F)F)n1.O=C(NCCCNC(=O)c1cc(-c2ccccc2)n[nH]1)c1ccn[nH]1.O=C(NCCCNC(=O)c1occc1-c1ccccc1)c1cc(-c2ccccc2)n[nH]1
InChIInChI=1S/C24H22N4O3.C22H26N4O3.C20H18F3N5O2.C20H22N4O3.C19H20N6O2.C19H20N4O3.C19H24N4O3.C18H20N6O2.C17H18N6O2/c29-23(21-16-20(27-28-21)18-10-5-2-6-11-18)25-13-7-14-26-24(30)22-19(12-15-31-22)17-8-3-1-4-9-17;1-22(2,3)19-11-10-18(29-19)21(28)24-13-7-12-23-20(27)17-14-16(25-26-17)15-8-5-4-6-9-15;21-20(22,23)17-9-4-8-14(26-17)18(29)24-10-5-11-25-19(30)16-12-15(27-28-16)13-6-2-1-3-7-13;1-2-15-9-10-18(27-15)20(26)22-12-6-11-21-19(25)17-13-16(23-24-17)14-7-4-3-5-8-14;1-13-11-20-12-17(23-13)19(27)22-9-5-8-21-18(26)16-10-15(24-25-16)14-6-3-2-4-7-14;1-13-8-9-17(26-13)19(25)21-11-5-10-20-18(24)16-12-15(22-23-16)14-6-3-2-4-7-14;24-18(16-13-15(22-23-16)14-7-2-1-3-8-14)20-10-6-11-21-19(25)17-9-4-5-12-26-17;1-24-11-16(21-12-24)18(26)20-9-5-8-19-17(25)15-10-14(22-23-15)13-6-3-2-4-7-13;24-16(13-7-10-20-21-13)18-8-4-9-19-17(25)15-11-14(22-23-15)12-5-2-1-3-6-12/h1-6,8-12,15-16H,7,13-14H2,(H,25,29)(H,26,30)(H,27,28);4-6,8-11,14H,7,12-13H2,1-3H3,(H,23,27)(H,24,28)(H,25,26);1-4,6-9,12H,5,10-11H2,(H,24,29)(H,25,30)(H,27,28);3-5,7-10,13H,2,6,11-12H2,1H3,(H,21,25)(H,22,26)(H,23,24);2-4,6-7,10-12H,5,8-9H2,1H3,(H,21,26)(H,22,27)(H,24,25);2-4,6-9,12H,5,10-11H2,1H3,(H,20,24)(H,21,25)(H,22,23);1-3,7-8,13,17H,4-6,9-12H2,(H,20,24)(H,21,25)(H,22,23);2-4,6-7,10-12H,5,8-9H2,1H3,(H,19,25)(H,20,26)(H,22,23);1-3,5-7,10-11H,4,8-9H2,(H,18,24)(H,19,25)(H,20,21)(H,22,23)
InChIKeyJZCNSTDDLSQCBS-UHFFFAOYSA-N
MW3356.75 g/mol
LogP22.07
Rot. Bonds65

About N-[3-[(5-tert-butylfuran-2-carbonyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[(5-ethylfuran-2-carbonyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[(5-methylfuran-2-carbonyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[(1-methylimidazole-4-carbonyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;6-methyl-N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]pyrazine-2-carboxamide;N-[3-(oxane-2-carbonylamino)propyl]-3-phenyl-1H-pyrazole-5-carboxamide;3-phenyl-N-[3-[(3-phenylfuran-2-carbonyl)amino]propyl]-1H-pyrazole-5-carboxamide;3-phenyl-N-[3-(1H-pyrazole-5-carbonylamino)propyl]-1H-pyrazole-5-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-6-(trifluoromethyl)pyridine-2-carboxamide

N-[3-[(5-tert-butylfuran-2-carbonyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[(5-ethylfuran-2-carbonyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[(5-methylfuran-2-carbonyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[(1-methylimidazole-4-carbonyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;6-methyl-N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]pyrazine-2-carboxamide;N-[3-(oxane-2-carbonylamino)propyl]-3-phenyl-1H-pyrazole-5-carboxamide;3-phenyl-N-[3-[(3-phenylfuran-2-carbonyl)amino]propyl]-1H-pyrazole-5-carboxamide;3-phenyl-N-[3-(1H-pyrazole-5-carbonylamino)propyl]-1H-pyrazole-5-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-6-(trifluoromethyl)pyridine-2-carboxamide (PubChem CID 159066435) has the molecular formula C178H190F3N43O23 and a molecular weight of 3356.75 g/mol. Its IUPAC name is N-[3-[(5-tert-butylfuran-2-carbonyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[(5-ethylfuran-2-carbonyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[(5-methylfuran-2-carbonyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[(1-methylimidazole-4-carbonyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;6-methyl-N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]pyrazine-2-carboxamide;N-[3-(oxane-2-carbonylamino)propyl]-3-phenyl-1H-pyrazole-5-carboxamide;3-phenyl-N-[3-[(3-phenylfuran-2-carbonyl)amino]propyl]-1H-pyrazole-5-carboxamide;3-phenyl-N-[3-(1H-pyrazole-5-carbonylamino)propyl]-1H-pyrazole-5-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-6-(trifluoromethyl)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[3-[(5-tert-butylfuran-2-carbonyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[(5-ethylfuran-2-carbonyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[(5-methylfuran-2-carbonyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[(1-methylimidazole-4-carbonyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;6-methyl-N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]pyrazine-2-carboxamide;N-[3-(oxane-2-carbonylamino)propyl]-3-phenyl-1H-pyrazole-5-carboxamide;3-phenyl-N-[3-[(3-phenylfuran-2-carbonyl)amino]propyl]-1H-pyrazole-5-carboxamide;3-phenyl-N-[3-(1H-pyrazole-5-carbonylamino)propyl]-1H-pyrazole-5-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-6-(trifluoromethyl)pyridine-2-carboxamide
PubChem CID159066435
Molecular FormulaC178H190F3N43O23
Molecular Weight3356.75 g/mol
Exact Mass3354.50
IUPAC NameN-[3-[(5-tert-butylfuran-2-carbonyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[(5-ethylfuran-2-carbonyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[(5-methylfuran-2-carbonyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[(1-methylimidazole-4-carbonyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;6-methyl-N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]pyrazine-2-carboxamide;N-[3-(oxane-2-carbonylamino)propyl]-3-phenyl-1H-pyrazole-5-carboxamide;3-phenyl-N-[3-[(3-phenylfuran-2-carbonyl)amino]propyl]-1H-pyrazole-5-carboxamide;3-phenyl-N-[3-(1H-pyrazole-5-carbonylamino)propyl]-1H-pyrazole-5-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-6-(trifluoromethyl)pyridine-2-carboxamide
SMILESCC(C)(C)c1ccc(C(=O)NCCCNC(=O)c2cc(-c3ccccc3)n[nH]2)o1.CCc1ccc(C(=O)NCCCNC(=O)c2cc(-c3ccccc3)n[nH]2)o1.Cc1ccc(C(=O)NCCCNC(=O)c2cc(-c3ccccc3)n[nH]2)o1.Cc1cncc(C(=O)NCCCNC(=O)c2cc(-c3ccccc3)n[nH]2)n1.Cn1cnc(C(=O)NCCCNC(=O)c2cc(-c3ccccc3)n[nH]2)c1.O=C(NCCCNC(=O)C1CCCCO1)c1cc(-c2ccccc2)n[nH]1.O=C(NCCCNC(=O)c1cc(-c2ccccc2)n[nH]1)c1cccc(C(F)(F)F)n1.O=C(NCCCNC(=O)c1cc(-c2ccccc2)n[nH]1)c1ccn[nH]1.O=C(NCCCNC(=O)c1occc1-c1ccccc1)c1cc(-c2ccccc2)n[nH]1
InChIInChI=1S/C24H22N4O3.C22H26N4O3.C20H18F3N5O2.C20H22N4O3.C19H20N6O2.C19H20N4O3.C19H24N4O3.C18H20N6O2.C17H18N6O2/c29-23(21-16-20(27-28-21)18-10-5-2-6-11-18)25-13-7-14-26-24(30)22-19(12-15-31-22)17-8-3-1-4-9-17;1-22(2,3)19-11-10-18(29-19)21(28)24-13-7-12-23-20(27)17-14-16(25-26-17)15-8-5-4-6-9-15;21-20(22,23)17-9-4-8-14(26-17)18(29)24-10-5-11-25-19(30)16-12-15(27-28-16)13-6-2-1-3-7-13;1-2-15-9-10-18(27-15)20(26)22-12-6-11-21-19(25)17-13-16(23-24-17)14-7-4-3-5-8-14;1-13-11-20-12-17(23-13)19(27)22-9-5-8-21-18(26)16-10-15(24-25-16)14-6-3-2-4-7-14;1-13-8-9-17(26-13)19(25)21-11-5-10-20-18(24)16-12-15(22-23-16)14-6-3-2-4-7-14;24-18(16-13-15(22-23-16)14-7-2-1-3-8-14)20-10-6-11-21-19(25)17-9-4-5-12-26-17;1-24-11-16(21-12-24)18(26)20-9-5-8-19-17(25)15-10-14(22-23-15)13-6-3-2-4-7-13;24-16(13-7-10-20-21-13)18-8-4-9-19-17(25)15-11-14(22-23-15)12-5-2-1-3-6-12/h1-6,8-12,15-16H,7,13-14H2,(H,25,29)(H,26,30)(H,27,28);4-6,8-11,14H,7,12-13H2,1-3H3,(H,23,27)(H,24,28)(H,25,26);1-4,6-9,12H,5,10-11H2,(H,24,29)(H,25,30)(H,27,28);3-5,7-10,13H,2,6,11-12H2,1H3,(H,21,25)(H,22,26)(H,23,24);2-4,6-7,10-12H,5,8-9H2,1H3,(H,21,26)(H,22,27)(H,24,25);2-4,6-9,12H,5,10-11H2,1H3,(H,20,24)(H,21,25)(H,22,23);1-3,7-8,13,17H,4-6,9-12H2,(H,20,24)(H,21,25)(H,22,23);2-4,6-7,10-12H,5,8-9H2,1H3,(H,19,25)(H,20,26)(H,22,23);1-3,5-7,10-11H,4,8-9H2,(H,18,24)(H,19,25)(H,20,21)(H,22,23)
InChIKeyJZCNSTDDLSQCBS-UHFFFAOYSA-N
XLogP22.07
TPSA928.88 Ų
H-Bond Donors28
H-Bond Acceptors38
Rotatable Bonds65
Heavy Atoms247
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003356.75
LogP ≤ 522.07
H-Bond Donors ≤ 528
H-Bond Acceptors ≤ 1038

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze N-[3-[(5-tert-butylfuran-2-carbonyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[(5-ethylfuran-2-carbonyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[(5-methylfuran-2-carbonyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[(1-methylimidazole-4-carbonyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;6-methyl-N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]pyrazine-2-carboxamide;N-[3-(oxane-2-carbonylamino)propyl]-3-phenyl-1H-pyrazole-5-carboxamide;3-phenyl-N-[3-[(3-phenylfuran-2-carbonyl)amino]propyl]-1H-pyrazole-5-carboxamide;3-phenyl-N-[3-(1H-pyrazole-5-carbonylamino)propyl]-1H-pyrazole-5-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-6-(trifluoromethyl)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

N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-6-(trifluoromethyl)pyridine-2-carboxamide
CID 131990284
N-[3-[(5-bromofuran-2-carbonyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide
CID 131990274
N-[2-(5-methylfuran-2-yl)ethyl]-3-phenyl-1H-pyrazole-5-carboxamide;2,2,2-trifluoroacetic acid
CID 57383620
4-phenyl-N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]pyridine-2-carboxamide
CID 131990295
N-[2-[[(1R,2R)-2-(trifluoromethyl)cyclohexanecarbonyl]amino]ethyl]-1H-pyrazole-5-carboxamide
CID 99782382
N-[2-[(2S)-oxolan-2-yl]ethyl]-3-phenylfuran-2-carboxamide
CID 30895473
3-phenyl-N-(3-pyrazol-1-ylpropyl)furan-2-carboxamide
CID 37392558
N-[2-(1-methylpyrrolidin-2-yl)ethyl]-3-phenyl-1H-pyrazole-5-carboxamide
CID 57383897
N-[[(2S)-oxolan-2-yl]methyl]-3-phenyl-1H-pyrazole-5-carboxamide
CID 50985207
5-ethyl-N-(oxan-2-yloxy)furan-2-carboxamide
CID 60613092
N-[4-(4-benzylpiperazin-1-yl)butyl]-3-phenylfuran-2-carboxamide
CID 55932766
5-hydroxy-N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]pyridine-2-carboxamide
CID 131991761

Frequently Asked Questions

What is the IUPAC name of N-[3-[(5-tert-butylfuran-2-carbonyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[(5-ethylfuran-2-carbonyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[(5-methylfuran-2-carbonyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[(1-methylimidazole-4-carbonyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;6-methyl-N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]pyrazine-2-carboxamide;N-[3-(oxane-2-carbonylamino)propyl]-3-phenyl-1H-pyrazole-5-carboxamide;3-phenyl-N-[3-[(3-phenylfuran-2-carbonyl)amino]propyl]-1H-pyrazole-5-carboxamide;3-phenyl-N-[3-(1H-pyrazole-5-carbonylamino)propyl]-1H-pyrazole-5-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-6-(trifluoromethyl)pyridine-2-carboxamide?
The IUPAC name of N-[3-[(5-tert-butylfuran-2-carbonyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[(5-ethylfuran-2-carbonyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[(5-methylfuran-2-carbonyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[(1-methylimidazole-4-carbonyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;6-methyl-N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]pyrazine-2-carboxamide;N-[3-(oxane-2-carbonylamino)propyl]-3-phenyl-1H-pyrazole-5-carboxamide;3-phenyl-N-[3-[(3-phenylfuran-2-carbonyl)amino]propyl]-1H-pyrazole-5-carboxamide;3-phenyl-N-[3-(1H-pyrazole-5-carbonylamino)propyl]-1H-pyrazole-5-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-6-(trifluoromethyl)pyridine-2-carboxamide (CID 159066435) is N-[3-[(5-tert-butylfuran-2-carbonyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[(5-ethylfuran-2-carbonyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[(5-methylfuran-2-carbonyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[(1-methylimidazole-4-carbonyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;6-methyl-N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]pyrazine-2-carboxamide;N-[3-(oxane-2-carbonylamino)propyl]-3-phenyl-1H-pyrazole-5-carboxamide;3-phenyl-N-[3-[(3-phenylfuran-2-carbonyl)amino]propyl]-1H-pyrazole-5-carboxamide;3-phenyl-N-[3-(1H-pyrazole-5-carbonylamino)propyl]-1H-pyrazole-5-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-6-(trifluoromethyl)pyridine-2-carboxamide.
What is the SMILES notation for N-[3-[(5-tert-butylfuran-2-carbonyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[(5-ethylfuran-2-carbonyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[(5-methylfuran-2-carbonyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[(1-methylimidazole-4-carbonyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;6-methyl-N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]pyrazine-2-carboxamide;N-[3-(oxane-2-carbonylamino)propyl]-3-phenyl-1H-pyrazole-5-carboxamide;3-phenyl-N-[3-[(3-phenylfuran-2-carbonyl)amino]propyl]-1H-pyrazole-5-carboxamide;3-phenyl-N-[3-(1H-pyrazole-5-carbonylamino)propyl]-1H-pyrazole-5-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-6-(trifluoromethyl)pyridine-2-carboxamide?
The canonical SMILES for N-[3-[(5-tert-butylfuran-2-carbonyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[(5-ethylfuran-2-carbonyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[(5-methylfuran-2-carbonyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[(1-methylimidazole-4-carbonyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;6-methyl-N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]pyrazine-2-carboxamide;N-[3-(oxane-2-carbonylamino)propyl]-3-phenyl-1H-pyrazole-5-carboxamide;3-phenyl-N-[3-[(3-phenylfuran-2-carbonyl)amino]propyl]-1H-pyrazole-5-carboxamide;3-phenyl-N-[3-(1H-pyrazole-5-carbonylamino)propyl]-1H-pyrazole-5-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-6-(trifluoromethyl)pyridine-2-carboxamide is CC(C)(C)c1ccc(C(=O)NCCCNC(=O)c2cc(-c3ccccc3)n[nH]2)o1.CCc1ccc(C(=O)NCCCNC(=O)c2cc(-c3ccccc3)n[nH]2)o1.Cc1ccc(C(=O)NCCCNC(=O)c2cc(-c3ccccc3)n[nH]2)o1.Cc1cncc(C(=O)NCCCNC(=O)c2cc(-c3ccccc3)n[nH]2)n1.Cn1cnc(C(=O)NCCCNC(=O)c2cc(-c3ccccc3)n[nH]2)c1.O=C(NCCCNC(=O)C1CCCCO1)c1cc(-c2ccccc2)n[nH]1.O=C(NCCCNC(=O)c1cc(-c2ccccc2)n[nH]1)c1cccc(C(F)(F)F)n1.O=C(NCCCNC(=O)c1cc(-c2ccccc2)n[nH]1)c1ccn[nH]1.O=C(NCCCNC(=O)c1occc1-c1ccccc1)c1cc(-c2ccccc2)n[nH]1.
What is the InChIKey of N-[3-[(5-tert-butylfuran-2-carbonyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[(5-ethylfuran-2-carbonyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[(5-methylfuran-2-carbonyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[(1-methylimidazole-4-carbonyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;6-methyl-N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]pyrazine-2-carboxamide;N-[3-(oxane-2-carbonylamino)propyl]-3-phenyl-1H-pyrazole-5-carboxamide;3-phenyl-N-[3-[(3-phenylfuran-2-carbonyl)amino]propyl]-1H-pyrazole-5-carboxamide;3-phenyl-N-[3-(1H-pyrazole-5-carbonylamino)propyl]-1H-pyrazole-5-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-6-(trifluoromethyl)pyridine-2-carboxamide?
The InChIKey is JZCNSTDDLSQCBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H22N4O3.C22H26N4O3.C20H18F3N5O2.C20H22N4O3.C19H20N6O2.C19H20N4O3.C19H24N4O3.C18H20N6O2.C17H18N6O2/c29-23(21-16-20(27-28-21)18-10-5-2-6-11-18)25-13-7-14-26-24(30)22-19(12-15-31-22)17-8-3-1-4-9-17;1-22(2,3)19-11-10-18(29-19)21(28)24-13-7-12-23-20(27)17-14-16(25-26-17)15-8-5-4-6-9-15;21-20(22,23)17-9-4-8-14(26-17)18(29)24-10-5-11-25-19(30)16-12-15(27-28-16)13-6-2-1-3-7-13;1-2-15-9-10-18(27-15)20(26)22-12-6-11-21-19(25)17-13-16(23-24-17)14-7-4-3-5-8-14;1-13-11-20-12-17(23-13)19(27)22-9-5-8-21-18(26)16-10-15(24-25-16)14-6-3-2-4-7-14;1-13-8-9-17(26-13)19(25)21-11-5-10-20-18(24)16-12-15(22-23-16)14-6-3-2-4-7-14;24-18(16-13-15(22-23-16)14-7-2-1-3-8-14)20-10-6-11-21-19(25)17-9-4-5-12-26-17;1-24-11-16(21-12-24)18(26)20-9-5-8-19-17(25)15-10-14(22-23-15)13-6-3-2-4-7-13;24-16(13-7-10-20-21-13)18-8-4-9-19-17(25)15-11-14(22-23-15)12-5-2-1-3-6-12/h1-6,8-12,15-16H,7,13-14H2,(H,25,29)(H,26,30)(H,27,28);4-6,8-11,14H,7,12-13H2,1-3H3,(H,23,27)(H,24,28)(H,25,26);1-4,6-9,12H,5,10-11H2,(H,24,29)(H,25,30)(H,27,28);3-5,7-10,13H,2,6,11-12H2,1H3,(H,21,25)(H,22,26)(H,23,24);2-4,6-7,10-12H,5,8-9H2,1H3,(H,21,26)(H,22,27)(H,24,25);2-4,6-9,12H,5,10-11H2,1H3,(H,20,24)(H,21,25)(H,22,23);1-3,7-8,13,17H,4-6,9-12H2,(H,20,24)(H,21,25)(H,22,23);2-4,6-7,10-12H,5,8-9H2,1H3,(H,19,25)(H,20,26)(H,22,23);1-3,5-7,10-11H,4,8-9H2,(H,18,24)(H,19,25)(H,20,21)(H,22,23).
What are the key properties of N-[3-[(5-tert-butylfuran-2-carbonyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[(5-ethylfuran-2-carbonyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[(5-methylfuran-2-carbonyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[(1-methylimidazole-4-carbonyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;6-methyl-N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]pyrazine-2-carboxamide;N-[3-(oxane-2-carbonylamino)propyl]-3-phenyl-1H-pyrazole-5-carboxamide;3-phenyl-N-[3-[(3-phenylfuran-2-carbonyl)amino]propyl]-1H-pyrazole-5-carboxamide;3-phenyl-N-[3-(1H-pyrazole-5-carbonylamino)propyl]-1H-pyrazole-5-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-6-(trifluoromethyl)pyridine-2-carboxamide?
N-[3-[(5-tert-butylfuran-2-carbonyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[(5-ethylfuran-2-carbonyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[(5-methylfuran-2-carbonyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[(1-methylimidazole-4-carbonyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;6-methyl-N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]pyrazine-2-carboxamide;N-[3-(oxane-2-carbonylamino)propyl]-3-phenyl-1H-pyrazole-5-carboxamide;3-phenyl-N-[3-[(3-phenylfuran-2-carbonyl)amino]propyl]-1H-pyrazole-5-carboxamide;3-phenyl-N-[3-(1H-pyrazole-5-carbonylamino)propyl]-1H-pyrazole-5-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-6-(trifluoromethyl)pyridine-2-carboxamide has a molecular weight of 3356.75 g/mol, XLogP of 22.07, 65 rotatable bonds, 28 hydrogen bond donors, and 38 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[(5-tert-butylfuran-2-carbonyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[(5-ethylfuran-2-carbonyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[(5-methylfuran-2-carbonyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;N-[3-[(1-methylimidazole-4-carbonyl)amino]propyl]-3-phenyl-1H-pyrazole-5-carboxamide;6-methyl-N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]pyrazine-2-carboxamide;N-[3-(oxane-2-carbonylamino)propyl]-3-phenyl-1H-pyrazole-5-carboxamide;3-phenyl-N-[3-[(3-phenylfuran-2-carbonyl)amino]propyl]-1H-pyrazole-5-carboxamide;3-phenyl-N-[3-(1H-pyrazole-5-carbonylamino)propyl]-1H-pyrazole-5-carboxamide;N-[3-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]propyl]-6-(trifluoromethyl)pyridine-2-carboxamide is sourced from PubChem (CID 159066435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).