4-[4-(6-methyl-1H-indazol-5-yl)phenyl]-N-pyridin-3-ylbutanamide;4-[4-(7-methyl-1H-indazol-5-yl)phenyl]-N-pyridin-3-ylbutanamide;6-methyl-N-[[1-[[4-(1-methylindazol-5-yl)phenyl]methyl]cyclopropyl]methyl]pyridine-3-carboxamide;5-methyl-N-[3-[4-(1-methylindazol-5-yl)phenyl]propyl]thiophene-2-carboxamide;4-[4-(2-oxo-1H-pyrimidin-5-yl)phenyl]-N-pyridin-3-ylbutanamide;N-[3-(4-quinolin-6-ylphenyl)propyl]pyridine-3-carboxamide

C138H132N22O7S — CID 164964850

IUPAC4-[4-(6-methyl-1H-indazol-5-yl)phenyl]-N-pyridin-3-ylbutanamide;4-[4-(7-methyl-1H-indazol-5-yl)phenyl]-N-pyridin-3-ylbutanamide;6-methyl-N-[[1-[[4-(1-methylindazol-5-yl)phenyl]methyl]cyclopropyl]methyl]pyridine-3-carboxamide;5-methyl-N-[3-[4-(1-methylindazol-5-yl)phenyl]propyl]thiophene-2-carboxamide;4-[4-(2-oxo-1H-pyrimidin-5-yl)phenyl]-N-pyridin-3-ylbutanamide;N-[3-(4-quinolin-6-ylphenyl)propyl]pyridine-3-carboxamide
SMILESCc1cc(-c2ccc(CCCC(=O)Nc3cccnc3)cc2)cc2cn[nH]c12.Cc1cc2[nH]ncc2cc1-c1ccc(CCCC(=O)Nc2cccnc2)cc1.Cc1ccc(C(=O)NCC2(Cc3ccc(-c4ccc5c(cnn5C)c4)cc3)CC2)cn1.Cc1ccc(C(=O)NCCCc2ccc(-c3ccc4c(cnn4C)c3)cc2)s1.O=C(CCCc1ccc(-c2cnc(=O)[nH]c2)cc1)Nc1cccnc1.O=C(NCCCc1ccc(-c2ccc3ncccc3c2)cc1)c1cccnc1
InChIInChI=1S/C26H26N4O.C24H21N3O.2C23H22N4O.C23H23N3OS.C19H18N4O2/c1-18-3-6-22(15-27-18)25(31)28-17-26(11-12-26)14-19-4-7-20(8-5-19)21-9-10-24-23(13-21)16-29-30(24)2;28-24(22-6-2-13-25-17-22)27-15-1-4-18-7-9-19(10-8-18)20-11-12-23-21(16-20)5-3-14-26-23;1-16-12-22-19(14-25-27-22)13-21(16)18-9-7-17(8-10-18)4-2-6-23(28)26-20-5-3-11-24-15-20;1-16-12-19(13-20-14-25-27-23(16)20)18-9-7-17(8-10-18)4-2-6-22(28)26-21-5-3-11-24-15-21;1-16-5-12-22(28-16)23(27)24-13-3-4-17-6-8-18(9-7-17)19-10-11-21-20(14-19)15-25-26(21)2;24-18(23-17-4-2-10-20-13-17)5-1-3-14-6-8-15(9-7-14)16-11-21-19(25)22-12-16/h3-10,13,15-16H,11-12,14,17H2,1-2H3,(H,28,31);2-3,5-14,16-17H,1,4,15H2,(H,27,28);2*3,5,7-15H,2,4,6H2,1H3,(H,25,27)(H,26,28);5-12,14-15H,3-4,13H2,1-2H3,(H,24,27);2,4,6-13H,1,3,5H2,(H,23,24)(H,21,22,25)
InChIKeyCIMYUBGKNMPOHH-UHFFFAOYSA-N
MW2242.79 g/mol
LogP26.91
Rot. Bonds36

About 4-[4-(6-methyl-1H-indazol-5-yl)phenyl]-N-pyridin-3-ylbutanamide;4-[4-(7-methyl-1H-indazol-5-yl)phenyl]-N-pyridin-3-ylbutanamide;6-methyl-N-[[1-[[4-(1-methylindazol-5-yl)phenyl]methyl]cyclopropyl]methyl]pyridine-3-carboxamide;5-methyl-N-[3-[4-(1-methylindazol-5-yl)phenyl]propyl]thiophene-2-carboxamide;4-[4-(2-oxo-1H-pyrimidin-5-yl)phenyl]-N-pyridin-3-ylbutanamide;N-[3-(4-quinolin-6-ylphenyl)propyl]pyridine-3-carboxamide

4-[4-(6-methyl-1H-indazol-5-yl)phenyl]-N-pyridin-3-ylbutanamide;4-[4-(7-methyl-1H-indazol-5-yl)phenyl]-N-pyridin-3-ylbutanamide;6-methyl-N-[[1-[[4-(1-methylindazol-5-yl)phenyl]methyl]cyclopropyl]methyl]pyridine-3-carboxamide;5-methyl-N-[3-[4-(1-methylindazol-5-yl)phenyl]propyl]thiophene-2-carboxamide;4-[4-(2-oxo-1H-pyrimidin-5-yl)phenyl]-N-pyridin-3-ylbutanamide;N-[3-(4-quinolin-6-ylphenyl)propyl]pyridine-3-carboxamide (PubChem CID 164964850) has the molecular formula C138H132N22O7S and a molecular weight of 2242.79 g/mol. Its IUPAC name is 4-[4-(6-methyl-1H-indazol-5-yl)phenyl]-N-pyridin-3-ylbutanamide;4-[4-(7-methyl-1H-indazol-5-yl)phenyl]-N-pyridin-3-ylbutanamide;6-methyl-N-[[1-[[4-(1-methylindazol-5-yl)phenyl]methyl]cyclopropyl]methyl]pyridine-3-carboxamide;5-methyl-N-[3-[4-(1-methylindazol-5-yl)phenyl]propyl]thiophene-2-carboxamide;4-[4-(2-oxo-1H-pyrimidin-5-yl)phenyl]-N-pyridin-3-ylbutanamide;N-[3-(4-quinolin-6-ylphenyl)propyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name4-[4-(6-methyl-1H-indazol-5-yl)phenyl]-N-pyridin-3-ylbutanamide;4-[4-(7-methyl-1H-indazol-5-yl)phenyl]-N-pyridin-3-ylbutanamide;6-methyl-N-[[1-[[4-(1-methylindazol-5-yl)phenyl]methyl]cyclopropyl]methyl]pyridine-3-carboxamide;5-methyl-N-[3-[4-(1-methylindazol-5-yl)phenyl]propyl]thiophene-2-carboxamide;4-[4-(2-oxo-1H-pyrimidin-5-yl)phenyl]-N-pyridin-3-ylbutanamide;N-[3-(4-quinolin-6-ylphenyl)propyl]pyridine-3-carboxamide
PubChem CID164964850
Molecular FormulaC138H132N22O7S
Molecular Weight2242.79 g/mol
Exact Mass2241.04
IUPAC Name4-[4-(6-methyl-1H-indazol-5-yl)phenyl]-N-pyridin-3-ylbutanamide;4-[4-(7-methyl-1H-indazol-5-yl)phenyl]-N-pyridin-3-ylbutanamide;6-methyl-N-[[1-[[4-(1-methylindazol-5-yl)phenyl]methyl]cyclopropyl]methyl]pyridine-3-carboxamide;5-methyl-N-[3-[4-(1-methylindazol-5-yl)phenyl]propyl]thiophene-2-carboxamide;4-[4-(2-oxo-1H-pyrimidin-5-yl)phenyl]-N-pyridin-3-ylbutanamide;N-[3-(4-quinolin-6-ylphenyl)propyl]pyridine-3-carboxamide
SMILESCc1cc(-c2ccc(CCCC(=O)Nc3cccnc3)cc2)cc2cn[nH]c12.Cc1cc2[nH]ncc2cc1-c1ccc(CCCC(=O)Nc2cccnc2)cc1.Cc1ccc(C(=O)NCC2(Cc3ccc(-c4ccc5c(cnn5C)c4)cc3)CC2)cn1.Cc1ccc(C(=O)NCCCc2ccc(-c3ccc4c(cnn4C)c3)cc2)s1.O=C(CCCc1ccc(-c2cnc(=O)[nH]c2)cc1)Nc1cccnc1.O=C(NCCCc1ccc(-c2ccc3ncccc3c2)cc1)c1cccnc1
InChIInChI=1S/C26H26N4O.C24H21N3O.2C23H22N4O.C23H23N3OS.C19H18N4O2/c1-18-3-6-22(15-27-18)25(31)28-17-26(11-12-26)14-19-4-7-20(8-5-19)21-9-10-24-23(13-21)16-29-30(24)2;28-24(22-6-2-13-25-17-22)27-15-1-4-18-7-9-19(10-8-18)20-11-12-23-21(16-20)5-3-14-26-23;1-16-12-22-19(14-25-27-22)13-21(16)18-9-7-17(8-10-18)4-2-6-23(28)26-20-5-3-11-24-15-20;1-16-12-19(13-20-14-25-27-23(16)20)18-9-7-17(8-10-18)4-2-6-22(28)26-21-5-3-11-24-15-21;1-16-5-12-22(28-16)23(27)24-13-3-4-17-6-8-18(9-7-17)19-10-11-21-20(14-19)15-25-26(21)2;24-18(23-17-4-2-10-20-13-17)5-1-3-14-6-8-15(9-7-14)16-11-21-19(25)22-12-16/h3-10,13,15-16H,11-12,14,17H2,1-2H3,(H,28,31);2-3,5-14,16-17H,1,4,15H2,(H,27,28);2*3,5,7-15H,2,4,6H2,1H3,(H,25,27)(H,26,28);5-12,14-15H,3-4,13H2,1-2H3,(H,24,27);2,4,6-13H,1,3,5H2,(H,23,24)(H,21,22,25)
InChIKeyCIMYUBGKNMPOHH-UHFFFAOYSA-N
XLogP26.91
TPSA390.69 Ų
H-Bond Donors9
H-Bond Acceptors21
Rotatable Bonds36
Heavy Atoms168
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002242.79
LogP ≤ 526.91
H-Bond Donors ≤ 59
H-Bond Acceptors ≤ 1021

Computed Properties (RDKit)

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

Analyze 4-[4-(6-methyl-1H-indazol-5-yl)phenyl]-N-pyridin-3-ylbutanamide;4-[4-(7-methyl-1H-indazol-5-yl)phenyl]-N-pyridin-3-ylbutanamide;6-methyl-N-[[1-[[4-(1-methylindazol-5-yl)phenyl]methyl]cyclopropyl]methyl]pyridine-3-carboxamide;5-methyl-N-[3-[4-(1-methylindazol-5-yl)phenyl]propyl]thiophene-2-carboxamide;4-[4-(2-oxo-1H-pyrimidin-5-yl)phenyl]-N-pyridin-3-ylbutanamide;N-[3-(4-quinolin-6-ylphenyl)propyl]pyridine-3-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 4-[4-(6-methyl-1H-indazol-5-yl)phenyl]-N-pyridin-3-ylbutanamide;4-[4-(7-methyl-1H-indazol-5-yl)phenyl]-N-pyridin-3-ylbutanamide;6-methyl-N-[[1-[[4-(1-methylindazol-5-yl)phenyl]methyl]cyclopropyl]methyl]pyridine-3-carboxamide;5-methyl-N-[3-[4-(1-methylindazol-5-yl)phenyl]propyl]thiophene-2-carboxamide;4-[4-(2-oxo-1H-pyrimidin-5-yl)phenyl]-N-pyridin-3-ylbutanamide;N-[3-(4-quinolin-6-ylphenyl)propyl]pyridine-3-carboxamide?
The IUPAC name of 4-[4-(6-methyl-1H-indazol-5-yl)phenyl]-N-pyridin-3-ylbutanamide;4-[4-(7-methyl-1H-indazol-5-yl)phenyl]-N-pyridin-3-ylbutanamide;6-methyl-N-[[1-[[4-(1-methylindazol-5-yl)phenyl]methyl]cyclopropyl]methyl]pyridine-3-carboxamide;5-methyl-N-[3-[4-(1-methylindazol-5-yl)phenyl]propyl]thiophene-2-carboxamide;4-[4-(2-oxo-1H-pyrimidin-5-yl)phenyl]-N-pyridin-3-ylbutanamide;N-[3-(4-quinolin-6-ylphenyl)propyl]pyridine-3-carboxamide (CID 164964850) is 4-[4-(6-methyl-1H-indazol-5-yl)phenyl]-N-pyridin-3-ylbutanamide;4-[4-(7-methyl-1H-indazol-5-yl)phenyl]-N-pyridin-3-ylbutanamide;6-methyl-N-[[1-[[4-(1-methylindazol-5-yl)phenyl]methyl]cyclopropyl]methyl]pyridine-3-carboxamide;5-methyl-N-[3-[4-(1-methylindazol-5-yl)phenyl]propyl]thiophene-2-carboxamide;4-[4-(2-oxo-1H-pyrimidin-5-yl)phenyl]-N-pyridin-3-ylbutanamide;N-[3-(4-quinolin-6-ylphenyl)propyl]pyridine-3-carboxamide.
What is the SMILES notation for 4-[4-(6-methyl-1H-indazol-5-yl)phenyl]-N-pyridin-3-ylbutanamide;4-[4-(7-methyl-1H-indazol-5-yl)phenyl]-N-pyridin-3-ylbutanamide;6-methyl-N-[[1-[[4-(1-methylindazol-5-yl)phenyl]methyl]cyclopropyl]methyl]pyridine-3-carboxamide;5-methyl-N-[3-[4-(1-methylindazol-5-yl)phenyl]propyl]thiophene-2-carboxamide;4-[4-(2-oxo-1H-pyrimidin-5-yl)phenyl]-N-pyridin-3-ylbutanamide;N-[3-(4-quinolin-6-ylphenyl)propyl]pyridine-3-carboxamide?
The canonical SMILES for 4-[4-(6-methyl-1H-indazol-5-yl)phenyl]-N-pyridin-3-ylbutanamide;4-[4-(7-methyl-1H-indazol-5-yl)phenyl]-N-pyridin-3-ylbutanamide;6-methyl-N-[[1-[[4-(1-methylindazol-5-yl)phenyl]methyl]cyclopropyl]methyl]pyridine-3-carboxamide;5-methyl-N-[3-[4-(1-methylindazol-5-yl)phenyl]propyl]thiophene-2-carboxamide;4-[4-(2-oxo-1H-pyrimidin-5-yl)phenyl]-N-pyridin-3-ylbutanamide;N-[3-(4-quinolin-6-ylphenyl)propyl]pyridine-3-carboxamide is Cc1cc(-c2ccc(CCCC(=O)Nc3cccnc3)cc2)cc2cn[nH]c12.Cc1cc2[nH]ncc2cc1-c1ccc(CCCC(=O)Nc2cccnc2)cc1.Cc1ccc(C(=O)NCC2(Cc3ccc(-c4ccc5c(cnn5C)c4)cc3)CC2)cn1.Cc1ccc(C(=O)NCCCc2ccc(-c3ccc4c(cnn4C)c3)cc2)s1.O=C(CCCc1ccc(-c2cnc(=O)[nH]c2)cc1)Nc1cccnc1.O=C(NCCCc1ccc(-c2ccc3ncccc3c2)cc1)c1cccnc1.
What is the InChIKey of 4-[4-(6-methyl-1H-indazol-5-yl)phenyl]-N-pyridin-3-ylbutanamide;4-[4-(7-methyl-1H-indazol-5-yl)phenyl]-N-pyridin-3-ylbutanamide;6-methyl-N-[[1-[[4-(1-methylindazol-5-yl)phenyl]methyl]cyclopropyl]methyl]pyridine-3-carboxamide;5-methyl-N-[3-[4-(1-methylindazol-5-yl)phenyl]propyl]thiophene-2-carboxamide;4-[4-(2-oxo-1H-pyrimidin-5-yl)phenyl]-N-pyridin-3-ylbutanamide;N-[3-(4-quinolin-6-ylphenyl)propyl]pyridine-3-carboxamide?
The InChIKey is CIMYUBGKNMPOHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H26N4O.C24H21N3O.2C23H22N4O.C23H23N3OS.C19H18N4O2/c1-18-3-6-22(15-27-18)25(31)28-17-26(11-12-26)14-19-4-7-20(8-5-19)21-9-10-24-23(13-21)16-29-30(24)2;28-24(22-6-2-13-25-17-22)27-15-1-4-18-7-9-19(10-8-18)20-11-12-23-21(16-20)5-3-14-26-23;1-16-12-22-19(14-25-27-22)13-21(16)18-9-7-17(8-10-18)4-2-6-23(28)26-20-5-3-11-24-15-20;1-16-12-19(13-20-14-25-27-23(16)20)18-9-7-17(8-10-18)4-2-6-22(28)26-21-5-3-11-24-15-21;1-16-5-12-22(28-16)23(27)24-13-3-4-17-6-8-18(9-7-17)19-10-11-21-20(14-19)15-25-26(21)2;24-18(23-17-4-2-10-20-13-17)5-1-3-14-6-8-15(9-7-14)16-11-21-19(25)22-12-16/h3-10,13,15-16H,11-12,14,17H2,1-2H3,(H,28,31);2-3,5-14,16-17H,1,4,15H2,(H,27,28);2*3,5,7-15H,2,4,6H2,1H3,(H,25,27)(H,26,28);5-12,14-15H,3-4,13H2,1-2H3,(H,24,27);2,4,6-13H,1,3,5H2,(H,23,24)(H,21,22,25).
What are the key properties of 4-[4-(6-methyl-1H-indazol-5-yl)phenyl]-N-pyridin-3-ylbutanamide;4-[4-(7-methyl-1H-indazol-5-yl)phenyl]-N-pyridin-3-ylbutanamide;6-methyl-N-[[1-[[4-(1-methylindazol-5-yl)phenyl]methyl]cyclopropyl]methyl]pyridine-3-carboxamide;5-methyl-N-[3-[4-(1-methylindazol-5-yl)phenyl]propyl]thiophene-2-carboxamide;4-[4-(2-oxo-1H-pyrimidin-5-yl)phenyl]-N-pyridin-3-ylbutanamide;N-[3-(4-quinolin-6-ylphenyl)propyl]pyridine-3-carboxamide?
4-[4-(6-methyl-1H-indazol-5-yl)phenyl]-N-pyridin-3-ylbutanamide;4-[4-(7-methyl-1H-indazol-5-yl)phenyl]-N-pyridin-3-ylbutanamide;6-methyl-N-[[1-[[4-(1-methylindazol-5-yl)phenyl]methyl]cyclopropyl]methyl]pyridine-3-carboxamide;5-methyl-N-[3-[4-(1-methylindazol-5-yl)phenyl]propyl]thiophene-2-carboxamide;4-[4-(2-oxo-1H-pyrimidin-5-yl)phenyl]-N-pyridin-3-ylbutanamide;N-[3-(4-quinolin-6-ylphenyl)propyl]pyridine-3-carboxamide has a molecular weight of 2242.79 g/mol, XLogP of 26.91, 36 rotatable bonds, 9 hydrogen bond donors, and 21 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-(6-methyl-1H-indazol-5-yl)phenyl]-N-pyridin-3-ylbutanamide;4-[4-(7-methyl-1H-indazol-5-yl)phenyl]-N-pyridin-3-ylbutanamide;6-methyl-N-[[1-[[4-(1-methylindazol-5-yl)phenyl]methyl]cyclopropyl]methyl]pyridine-3-carboxamide;5-methyl-N-[3-[4-(1-methylindazol-5-yl)phenyl]propyl]thiophene-2-carboxamide;4-[4-(2-oxo-1H-pyrimidin-5-yl)phenyl]-N-pyridin-3-ylbutanamide;N-[3-(4-quinolin-6-ylphenyl)propyl]pyridine-3-carboxamide is sourced from PubChem (CID 164964850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).