4-[4-(1,3-benzoxazol-5-yl)phenyl]-N-pyridin-3-ylbutanamide;4-[4-(2-methoxy-3-pyridinyl)phenyl]-N-pyridin-3-ylbutanamide;4-[4-(4-methyl-1H-indazol-5-yl)phenyl]-N-pyridin-3-ylbutanamide;4-[4-(2-oxo-1,3-dihydroinden-5-yl)phenyl]-N-pyridin-3-ylbutanamide;4-[4-(1H-pyrazol-4-yl)phenyl]-N-pyridin-3-ylbutanamide;N-pyridin-3-yl-4-(4-pyrimidin-5-ylphenyl)butanamide

C127H120N20O9 — CID 164978946

IUPAC4-[4-(1,3-benzoxazol-5-yl)phenyl]-N-pyridin-3-ylbutanamide;4-[4-(2-methoxy-3-pyridinyl)phenyl]-N-pyridin-3-ylbutanamide;4-[4-(4-methyl-1H-indazol-5-yl)phenyl]-N-pyridin-3-ylbutanamide;4-[4-(2-oxo-1,3-dihydroinden-5-yl)phenyl]-N-pyridin-3-ylbutanamide;4-[4-(1H-pyrazol-4-yl)phenyl]-N-pyridin-3-ylbutanamide;N-pyridin-3-yl-4-(4-pyrimidin-5-ylphenyl)butanamide
SMILESCOc1ncccc1-c1ccc(CCCC(=O)Nc2cccnc2)cc1.Cc1c(-c2ccc(CCCC(=O)Nc3cccnc3)cc2)ccc2[nH]ncc12.O=C(CCCc1ccc(-c2ccc3ocnc3c2)cc1)Nc1cccnc1.O=C(CCCc1ccc(-c2cn[nH]c2)cc1)Nc1cccnc1.O=C(CCCc1ccc(-c2cncnc2)cc1)Nc1cccnc1.O=C1Cc2ccc(-c3ccc(CCCC(=O)Nc4cccnc4)cc3)cc2C1
InChIInChI=1S/C24H22N2O2.C23H22N4O.C22H19N3O2.C21H21N3O2.C19H18N4O.C18H18N4O/c27-23-14-20-11-10-19(13-21(20)15-23)18-8-6-17(7-9-18)3-1-5-24(28)26-22-4-2-12-25-16-22;1-16-20(11-12-22-21(16)15-25-27-22)18-9-7-17(8-10-18)4-2-6-23(28)26-19-5-3-13-24-14-19;26-22(25-19-4-2-12-23-14-19)5-1-3-16-6-8-17(9-7-16)18-10-11-21-20(13-18)24-15-27-21;1-26-21-19(7-4-14-23-21)17-11-9-16(10-12-17)5-2-8-20(25)24-18-6-3-13-22-15-18;24-19(23-18-4-2-10-20-13-18)5-1-3-15-6-8-16(9-7-15)17-11-21-14-22-12-17;23-18(22-17-4-2-10-19-13-17)5-1-3-14-6-8-15(9-7-14)16-11-20-21-12-16/h2,4,6-13,16H,1,3,5,14-15H2,(H,26,28);3,5,7-15H,2,4,6H2,1H3,(H,25,27)(H,26,28);2,4,6-15H,1,3,5H2,(H,25,26);3-4,6-7,9-15H,2,5,8H2,1H3,(H,24,25);2,4,6-14H,1,3,5H2,(H,23,24);2,4,6-13H,1,3,5H2,(H,20,21)(H,22,23)
InChIKeyFEQMAEWVEVNFLS-UHFFFAOYSA-N
MW2070.49 g/mol
LogP25.17
Rot. Bonds37

About 4-[4-(1,3-benzoxazol-5-yl)phenyl]-N-pyridin-3-ylbutanamide;4-[4-(2-methoxy-3-pyridinyl)phenyl]-N-pyridin-3-ylbutanamide;4-[4-(4-methyl-1H-indazol-5-yl)phenyl]-N-pyridin-3-ylbutanamide;4-[4-(2-oxo-1,3-dihydroinden-5-yl)phenyl]-N-pyridin-3-ylbutanamide;4-[4-(1H-pyrazol-4-yl)phenyl]-N-pyridin-3-ylbutanamide;N-pyridin-3-yl-4-(4-pyrimidin-5-ylphenyl)butanamide

4-[4-(1,3-benzoxazol-5-yl)phenyl]-N-pyridin-3-ylbutanamide;4-[4-(2-methoxy-3-pyridinyl)phenyl]-N-pyridin-3-ylbutanamide;4-[4-(4-methyl-1H-indazol-5-yl)phenyl]-N-pyridin-3-ylbutanamide;4-[4-(2-oxo-1,3-dihydroinden-5-yl)phenyl]-N-pyridin-3-ylbutanamide;4-[4-(1H-pyrazol-4-yl)phenyl]-N-pyridin-3-ylbutanamide;N-pyridin-3-yl-4-(4-pyrimidin-5-ylphenyl)butanamide (PubChem CID 164978946) has the molecular formula C127H120N20O9 and a molecular weight of 2070.49 g/mol. Its IUPAC name is 4-[4-(1,3-benzoxazol-5-yl)phenyl]-N-pyridin-3-ylbutanamide;4-[4-(2-methoxy-3-pyridinyl)phenyl]-N-pyridin-3-ylbutanamide;4-[4-(4-methyl-1H-indazol-5-yl)phenyl]-N-pyridin-3-ylbutanamide;4-[4-(2-oxo-1,3-dihydroinden-5-yl)phenyl]-N-pyridin-3-ylbutanamide;4-[4-(1H-pyrazol-4-yl)phenyl]-N-pyridin-3-ylbutanamide;N-pyridin-3-yl-4-(4-pyrimidin-5-ylphenyl)butanamide.

Molecular Properties

Compound Name4-[4-(1,3-benzoxazol-5-yl)phenyl]-N-pyridin-3-ylbutanamide;4-[4-(2-methoxy-3-pyridinyl)phenyl]-N-pyridin-3-ylbutanamide;4-[4-(4-methyl-1H-indazol-5-yl)phenyl]-N-pyridin-3-ylbutanamide;4-[4-(2-oxo-1,3-dihydroinden-5-yl)phenyl]-N-pyridin-3-ylbutanamide;4-[4-(1H-pyrazol-4-yl)phenyl]-N-pyridin-3-ylbutanamide;N-pyridin-3-yl-4-(4-pyrimidin-5-ylphenyl)butanamide
PubChem CID164978946
Molecular FormulaC127H120N20O9
Molecular Weight2070.49 g/mol
Exact Mass2068.95
IUPAC Name4-[4-(1,3-benzoxazol-5-yl)phenyl]-N-pyridin-3-ylbutanamide;4-[4-(2-methoxy-3-pyridinyl)phenyl]-N-pyridin-3-ylbutanamide;4-[4-(4-methyl-1H-indazol-5-yl)phenyl]-N-pyridin-3-ylbutanamide;4-[4-(2-oxo-1,3-dihydroinden-5-yl)phenyl]-N-pyridin-3-ylbutanamide;4-[4-(1H-pyrazol-4-yl)phenyl]-N-pyridin-3-ylbutanamide;N-pyridin-3-yl-4-(4-pyrimidin-5-ylphenyl)butanamide
SMILESCOc1ncccc1-c1ccc(CCCC(=O)Nc2cccnc2)cc1.Cc1c(-c2ccc(CCCC(=O)Nc3cccnc3)cc2)ccc2[nH]ncc12.O=C(CCCc1ccc(-c2ccc3ocnc3c2)cc1)Nc1cccnc1.O=C(CCCc1ccc(-c2cn[nH]c2)cc1)Nc1cccnc1.O=C(CCCc1ccc(-c2cncnc2)cc1)Nc1cccnc1.O=C1Cc2ccc(-c3ccc(CCCC(=O)Nc4cccnc4)cc3)cc2C1
InChIInChI=1S/C24H22N2O2.C23H22N4O.C22H19N3O2.C21H21N3O2.C19H18N4O.C18H18N4O/c27-23-14-20-11-10-19(13-21(20)15-23)18-8-6-17(7-9-18)3-1-5-24(28)26-22-4-2-12-25-16-22;1-16-20(11-12-22-21(16)15-25-27-22)18-9-7-17(8-10-18)4-2-6-23(28)26-19-5-3-13-24-14-19;26-22(25-19-4-2-12-23-14-19)5-1-3-16-6-8-17(9-7-16)18-10-11-21-20(13-18)24-15-27-21;1-26-21-19(7-4-14-23-21)17-11-9-16(10-12-17)5-2-8-20(25)24-18-6-3-13-22-15-18;24-19(23-18-4-2-10-20-13-18)5-1-3-15-6-8-16(9-7-15)17-11-21-14-22-12-17;23-18(22-17-4-2-10-19-13-17)5-1-3-14-6-8-15(9-7-14)16-11-20-21-12-16/h2,4,6-13,16H,1,3,5,14-15H2,(H,26,28);3,5,7-15H,2,4,6H2,1H3,(H,25,27)(H,26,28);2,4,6-15H,1,3,5H2,(H,25,26);3-4,6-7,9-15H,2,5,8H2,1H3,(H,24,25);2,4,6-14H,1,3,5H2,(H,23,24);2,4,6-13H,1,3,5H2,(H,20,21)(H,22,23)
InChIKeyFEQMAEWVEVNFLS-UHFFFAOYSA-N
XLogP25.17
TPSA400.30 Ų
H-Bond Donors8
H-Bond Acceptors21
Rotatable Bonds37
Heavy Atoms156
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002070.49
LogP ≤ 525.17
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1021

Analyze 4-[4-(1,3-benzoxazol-5-yl)phenyl]-N-pyridin-3-ylbutanamide;4-[4-(2-methoxy-3-pyridinyl)phenyl]-N-pyridin-3-ylbutanamide;4-[4-(4-methyl-1H-indazol-5-yl)phenyl]-N-pyridin-3-ylbutanamide;4-[4-(2-oxo-1,3-dihydroinden-5-yl)phenyl]-N-pyridin-3-ylbutanamide;4-[4-(1H-pyrazol-4-yl)phenyl]-N-pyridin-3-ylbutanamide;N-pyridin-3-yl-4-(4-pyrimidin-5-ylphenyl)butanamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 4-[4-(1,3-benzoxazol-5-yl)phenyl]-N-pyridin-3-ylbutanamide;4-[4-(2-methoxy-3-pyridinyl)phenyl]-N-pyridin-3-ylbutanamide;4-[4-(4-methyl-1H-indazol-5-yl)phenyl]-N-pyridin-3-ylbutanamide;4-[4-(2-oxo-1,3-dihydroinden-5-yl)phenyl]-N-pyridin-3-ylbutanamide;4-[4-(1H-pyrazol-4-yl)phenyl]-N-pyridin-3-ylbutanamide;N-pyridin-3-yl-4-(4-pyrimidin-5-ylphenyl)butanamide?
The IUPAC name of 4-[4-(1,3-benzoxazol-5-yl)phenyl]-N-pyridin-3-ylbutanamide;4-[4-(2-methoxy-3-pyridinyl)phenyl]-N-pyridin-3-ylbutanamide;4-[4-(4-methyl-1H-indazol-5-yl)phenyl]-N-pyridin-3-ylbutanamide;4-[4-(2-oxo-1,3-dihydroinden-5-yl)phenyl]-N-pyridin-3-ylbutanamide;4-[4-(1H-pyrazol-4-yl)phenyl]-N-pyridin-3-ylbutanamide;N-pyridin-3-yl-4-(4-pyrimidin-5-ylphenyl)butanamide (CID 164978946) is 4-[4-(1,3-benzoxazol-5-yl)phenyl]-N-pyridin-3-ylbutanamide;4-[4-(2-methoxy-3-pyridinyl)phenyl]-N-pyridin-3-ylbutanamide;4-[4-(4-methyl-1H-indazol-5-yl)phenyl]-N-pyridin-3-ylbutanamide;4-[4-(2-oxo-1,3-dihydroinden-5-yl)phenyl]-N-pyridin-3-ylbutanamide;4-[4-(1H-pyrazol-4-yl)phenyl]-N-pyridin-3-ylbutanamide;N-pyridin-3-yl-4-(4-pyrimidin-5-ylphenyl)butanamide.
What is the SMILES notation for 4-[4-(1,3-benzoxazol-5-yl)phenyl]-N-pyridin-3-ylbutanamide;4-[4-(2-methoxy-3-pyridinyl)phenyl]-N-pyridin-3-ylbutanamide;4-[4-(4-methyl-1H-indazol-5-yl)phenyl]-N-pyridin-3-ylbutanamide;4-[4-(2-oxo-1,3-dihydroinden-5-yl)phenyl]-N-pyridin-3-ylbutanamide;4-[4-(1H-pyrazol-4-yl)phenyl]-N-pyridin-3-ylbutanamide;N-pyridin-3-yl-4-(4-pyrimidin-5-ylphenyl)butanamide?
The canonical SMILES for 4-[4-(1,3-benzoxazol-5-yl)phenyl]-N-pyridin-3-ylbutanamide;4-[4-(2-methoxy-3-pyridinyl)phenyl]-N-pyridin-3-ylbutanamide;4-[4-(4-methyl-1H-indazol-5-yl)phenyl]-N-pyridin-3-ylbutanamide;4-[4-(2-oxo-1,3-dihydroinden-5-yl)phenyl]-N-pyridin-3-ylbutanamide;4-[4-(1H-pyrazol-4-yl)phenyl]-N-pyridin-3-ylbutanamide;N-pyridin-3-yl-4-(4-pyrimidin-5-ylphenyl)butanamide is COc1ncccc1-c1ccc(CCCC(=O)Nc2cccnc2)cc1.Cc1c(-c2ccc(CCCC(=O)Nc3cccnc3)cc2)ccc2[nH]ncc12.O=C(CCCc1ccc(-c2ccc3ocnc3c2)cc1)Nc1cccnc1.O=C(CCCc1ccc(-c2cn[nH]c2)cc1)Nc1cccnc1.O=C(CCCc1ccc(-c2cncnc2)cc1)Nc1cccnc1.O=C1Cc2ccc(-c3ccc(CCCC(=O)Nc4cccnc4)cc3)cc2C1.
What is the InChIKey of 4-[4-(1,3-benzoxazol-5-yl)phenyl]-N-pyridin-3-ylbutanamide;4-[4-(2-methoxy-3-pyridinyl)phenyl]-N-pyridin-3-ylbutanamide;4-[4-(4-methyl-1H-indazol-5-yl)phenyl]-N-pyridin-3-ylbutanamide;4-[4-(2-oxo-1,3-dihydroinden-5-yl)phenyl]-N-pyridin-3-ylbutanamide;4-[4-(1H-pyrazol-4-yl)phenyl]-N-pyridin-3-ylbutanamide;N-pyridin-3-yl-4-(4-pyrimidin-5-ylphenyl)butanamide?
The InChIKey is FEQMAEWVEVNFLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H22N2O2.C23H22N4O.C22H19N3O2.C21H21N3O2.C19H18N4O.C18H18N4O/c27-23-14-20-11-10-19(13-21(20)15-23)18-8-6-17(7-9-18)3-1-5-24(28)26-22-4-2-12-25-16-22;1-16-20(11-12-22-21(16)15-25-27-22)18-9-7-17(8-10-18)4-2-6-23(28)26-19-5-3-13-24-14-19;26-22(25-19-4-2-12-23-14-19)5-1-3-16-6-8-17(9-7-16)18-10-11-21-20(13-18)24-15-27-21;1-26-21-19(7-4-14-23-21)17-11-9-16(10-12-17)5-2-8-20(25)24-18-6-3-13-22-15-18;24-19(23-18-4-2-10-20-13-18)5-1-3-15-6-8-16(9-7-15)17-11-21-14-22-12-17;23-18(22-17-4-2-10-19-13-17)5-1-3-14-6-8-15(9-7-14)16-11-20-21-12-16/h2,4,6-13,16H,1,3,5,14-15H2,(H,26,28);3,5,7-15H,2,4,6H2,1H3,(H,25,27)(H,26,28);2,4,6-15H,1,3,5H2,(H,25,26);3-4,6-7,9-15H,2,5,8H2,1H3,(H,24,25);2,4,6-14H,1,3,5H2,(H,23,24);2,4,6-13H,1,3,5H2,(H,20,21)(H,22,23).
What are the key properties of 4-[4-(1,3-benzoxazol-5-yl)phenyl]-N-pyridin-3-ylbutanamide;4-[4-(2-methoxy-3-pyridinyl)phenyl]-N-pyridin-3-ylbutanamide;4-[4-(4-methyl-1H-indazol-5-yl)phenyl]-N-pyridin-3-ylbutanamide;4-[4-(2-oxo-1,3-dihydroinden-5-yl)phenyl]-N-pyridin-3-ylbutanamide;4-[4-(1H-pyrazol-4-yl)phenyl]-N-pyridin-3-ylbutanamide;N-pyridin-3-yl-4-(4-pyrimidin-5-ylphenyl)butanamide?
4-[4-(1,3-benzoxazol-5-yl)phenyl]-N-pyridin-3-ylbutanamide;4-[4-(2-methoxy-3-pyridinyl)phenyl]-N-pyridin-3-ylbutanamide;4-[4-(4-methyl-1H-indazol-5-yl)phenyl]-N-pyridin-3-ylbutanamide;4-[4-(2-oxo-1,3-dihydroinden-5-yl)phenyl]-N-pyridin-3-ylbutanamide;4-[4-(1H-pyrazol-4-yl)phenyl]-N-pyridin-3-ylbutanamide;N-pyridin-3-yl-4-(4-pyrimidin-5-ylphenyl)butanamide has a molecular weight of 2070.49 g/mol, XLogP of 25.17, 37 rotatable bonds, 8 hydrogen bond donors, and 21 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-(1,3-benzoxazol-5-yl)phenyl]-N-pyridin-3-ylbutanamide;4-[4-(2-methoxy-3-pyridinyl)phenyl]-N-pyridin-3-ylbutanamide;4-[4-(4-methyl-1H-indazol-5-yl)phenyl]-N-pyridin-3-ylbutanamide;4-[4-(2-oxo-1,3-dihydroinden-5-yl)phenyl]-N-pyridin-3-ylbutanamide;4-[4-(1H-pyrazol-4-yl)phenyl]-N-pyridin-3-ylbutanamide;N-pyridin-3-yl-4-(4-pyrimidin-5-ylphenyl)butanamide is sourced from PubChem (CID 164978946), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).