4-[4-(6-amino-3-pyridinyl)phenyl]-N-[5-(2-methyl-1,3-thiazol-4-yl)-2-pyridinyl]oxane-4-carboxamide;4-[4-(2-aminopyrimidin-5-yl)phenyl]-N-(3-cyano-4-methylphenyl)oxane-4-carboxamide;4-[4-(2-aminopyrimidin-5-yl)phenyl]-N-(3-phenylmethoxyphenyl)oxane-4-carboxamide;N-(2-methoxy-4-pyridinyl)-1-[4-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]cyclobutane-1-carboxamide;N-(2-methyl-4-pyridinyl)-1-[4-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]cyclobutane-1-carboxamide

C127H120N22O10S — CID 158371542

About 4-[4-(6-amino-3-pyridinyl)phenyl]-N-[5-(2-methyl-1,3-thiazol-4-yl)-2-pyridinyl]oxane-4-carboxamide;4-[4-(2-aminopyrimidin-5-yl)phenyl]-N-(3-cyano-4-methylphenyl)oxane-4-carboxamide;4-[4-(2-aminopyrimidin-5-yl)phenyl]-N-(3-phenylmethoxyphenyl)oxane-4-carboxamide;N-(2-methoxy-4-pyridinyl)-1-[4-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]cyclobutane-1-carboxamide;N-(2-methyl-4-pyridinyl)-1-[4-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]cyclobutane-1-carboxamide

4-[4-(6-amino-3-pyridinyl)phenyl]-N-[5-(2-methyl-1,3-thiazol-4-yl)-2-pyridinyl]oxane-4-carboxamide;4-[4-(2-aminopyrimidin-5-yl)phenyl]-N-(3-cyano-4-methylphenyl)oxane-4-carboxamide;4-[4-(2-aminopyrimidin-5-yl)phenyl]-N-(3-phenylmethoxyphenyl)oxane-4-carboxamide;N-(2-methoxy-4-pyridinyl)-1-[4-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]cyclobutane-1-carboxamide;N-(2-methyl-4-pyridinyl)-1-[4-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]cyclobutane-1-carboxamide (PubChem CID 158371542) has the molecular formula C127H120N22O10S and a molecular weight of 2146.57 g/mol. Its IUPAC name is 4-[4-(6-amino-3-pyridinyl)phenyl]-N-[5-(2-methyl-1,3-thiazol-4-yl)-2-pyridinyl]oxane-4-carboxamide;4-[4-(2-aminopyrimidin-5-yl)phenyl]-N-(3-cyano-4-methylphenyl)oxane-4-carboxamide;4-[4-(2-aminopyrimidin-5-yl)phenyl]-N-(3-phenylmethoxyphenyl)oxane-4-carboxamide;N-(2-methoxy-4-pyridinyl)-1-[4-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]cyclobutane-1-carboxamide;N-(2-methyl-4-pyridinyl)-1-[4-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]cyclobutane-1-carboxamide.

Molecular Properties

• Compound Name: 4-[4-(6-amino-3-pyridinyl)phenyl]-N-[5-(2-methyl-1,3-thiazol-4-yl)-2-pyridinyl]oxane-4-carboxamide;4-[4-(2-aminopyrimidin-5-yl)phenyl]-N-(3-cyano-4-methylphenyl)oxane-4-carboxamide;4-[4-(2-aminopyrimidin-5-yl)phenyl]-N-(3-phenylmethoxyphenyl)oxane-4-carboxamide;N-(2-methoxy-4-pyridinyl)-1-[4-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]cyclobutane-1-carboxamide;N-(2-methyl-4-pyridinyl)-1-[4-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]cyclobutane-1-carboxamide
• PubChem CID: 158371542
• Molecular Formula: C127H120N22O10S
• Molecular Weight: 2146.57 g/mol
• Exact Mass: 2144.93
• IUPAC Name: 4-[4-(6-amino-3-pyridinyl)phenyl]-N-[5-(2-methyl-1,3-thiazol-4-yl)-2-pyridinyl]oxane-4-carboxamide;4-[4-(2-aminopyrimidin-5-yl)phenyl]-N-(3-cyano-4-methylphenyl)oxane-4-carboxamide;4-[4-(2-aminopyrimidin-5-yl)phenyl]-N-(3-phenylmethoxyphenyl)oxane-4-carboxamide;N-(2-methoxy-4-pyridinyl)-1-[4-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]cyclobutane-1-carboxamide;N-(2-methyl-4-pyridinyl)-1-[4-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]cyclobutane-1-carboxamide
• SMILES: COc1cc(NC(=O)C2(c3ccc(-c4cnc5[nH]ccc5c4)cc3)CCC2)ccn1.Cc1cc(NC(=O)C2(c3ccc(-c4cnc5[nH]ccc5c4)cc3)CCC2)ccn1.Cc1ccc(NC(=O)C2(c3ccc(-c4cnc(N)nc4)cc3)CCOCC2)cc1C#N.Cc1nc(-c2ccc(NC(=O)C3(c4ccc(-c5ccc(N)nc5)cc4)CCOCC3)nc2)cs1.Nc1ncc(-c2ccc(C3(C(=O)Nc4cccc(OCc5ccccc5)c4)CCOCC3)cc2)cn1
• InChI: InChI=1S/C29H28N4O3.C26H25N5O2S.C24H23N5O2.C24H22N4O2.C24H22N4O/c30-28-31-18-23(19-32-28)22-9-11-24(12-10-22)29(13-15-35-16-14-29)27(34)33-25-7-4-8-26(17-25)36-20-21-5-2-1-3-6-21;1-17-30-22(16-34-17)20-5-9-24(29-15-20)31-25(32)26(10-12-33-13-11-26)21-6-2-18(3-7-21)19-4-8-23(27)28-14-19;1-16-2-7-21(12-18(16)13-25)29-22(30)24(8-10-31-11-9-24)20-5-3-17(4-6-20)19-14-27-23(26)28-15-19;1-30-21-14-20(8-12-25-21)28-23(29)24(9-2-10-24)19-5-3-16(4-6-19)18-13-17-7-11-26-22(17)27-15-18;1-16-13-21(8-12-25-16)28-23(29)24(9-2-10-24)20-5-3-17(4-6-20)19-14-18-7-11-26-22(18)27-15-19/h1-12,17-19H,13-16,20H2,(H,33,34)(H2,30,31,32);2-9,14-16H,10-13H2,1H3,(H2,27,28)(H,29,31,32);2-7,12,14-15H,8-11H2,1H3,(H,29,30)(H2,26,27,28);3-8,11-15H,2,9-10H2,1H3,(H,26,27)(H,25,28,29);3-8,11-15H,2,9-10H2,1H3,(H,26,27)(H,25,28,29)
• InChIKey: GURCJBVSLSBRBU-UHFFFAOYSA-N
• XLogP: 23.12
• TPSA: 466.87 Ų
• H-Bond Donors: 10
• H-Bond Acceptors: 26
• Rotatable Bonds: 25
• Heavy Atoms: 160
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2146.57
LogP ≤ 5	23.12
H-Bond Donors ≤ 5	10
H-Bond Acceptors ≤ 10	26

Frequently Asked Questions

What is the IUPAC name of 4-[4-(6-amino-3-pyridinyl)phenyl]-N-[5-(2-methyl-1,3-thiazol-4-yl)-2-pyridinyl]oxane-4-carboxamide;4-[4-(2-aminopyrimidin-5-yl)phenyl]-N-(3-cyano-4-methylphenyl)oxane-4-carboxamide;4-[4-(2-aminopyrimidin-5-yl)phenyl]-N-(3-phenylmethoxyphenyl)oxane-4-carboxamide;N-(2-methoxy-4-pyridinyl)-1-[4-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]cyclobutane-1-carboxamide;N-(2-methyl-4-pyridinyl)-1-[4-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]cyclobutane-1-carboxamide?

The IUPAC name of 4-[4-(6-amino-3-pyridinyl)phenyl]-N-[5-(2-methyl-1,3-thiazol-4-yl)-2-pyridinyl]oxane-4-carboxamide;4-[4-(2-aminopyrimidin-5-yl)phenyl]-N-(3-cyano-4-methylphenyl)oxane-4-carboxamide;4-[4-(2-aminopyrimidin-5-yl)phenyl]-N-(3-phenylmethoxyphenyl)oxane-4-carboxamide;N-(2-methoxy-4-pyridinyl)-1-[4-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]cyclobutane-1-carboxamide;N-(2-methyl-4-pyridinyl)-1-[4-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]cyclobutane-1-carboxamide (CID 158371542) is 4-[4-(6-amino-3-pyridinyl)phenyl]-N-[5-(2-methyl-1,3-thiazol-4-yl)-2-pyridinyl]oxane-4-carboxamide;4-[4-(2-aminopyrimidin-5-yl)phenyl]-N-(3-cyano-4-methylphenyl)oxane-4-carboxamide;4-[4-(2-aminopyrimidin-5-yl)phenyl]-N-(3-phenylmethoxyphenyl)oxane-4-carboxamide;N-(2-methoxy-4-pyridinyl)-1-[4-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]cyclobutane-1-carboxamide;N-(2-methyl-4-pyridinyl)-1-[4-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]cyclobutane-1-carboxamide.

What is the SMILES notation for 4-[4-(6-amino-3-pyridinyl)phenyl]-N-[5-(2-methyl-1,3-thiazol-4-yl)-2-pyridinyl]oxane-4-carboxamide;4-[4-(2-aminopyrimidin-5-yl)phenyl]-N-(3-cyano-4-methylphenyl)oxane-4-carboxamide;4-[4-(2-aminopyrimidin-5-yl)phenyl]-N-(3-phenylmethoxyphenyl)oxane-4-carboxamide;N-(2-methoxy-4-pyridinyl)-1-[4-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]cyclobutane-1-carboxamide;N-(2-methyl-4-pyridinyl)-1-[4-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]cyclobutane-1-carboxamide?

The canonical SMILES for 4-[4-(6-amino-3-pyridinyl)phenyl]-N-[5-(2-methyl-1,3-thiazol-4-yl)-2-pyridinyl]oxane-4-carboxamide;4-[4-(2-aminopyrimidin-5-yl)phenyl]-N-(3-cyano-4-methylphenyl)oxane-4-carboxamide;4-[4-(2-aminopyrimidin-5-yl)phenyl]-N-(3-phenylmethoxyphenyl)oxane-4-carboxamide;N-(2-methoxy-4-pyridinyl)-1-[4-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]cyclobutane-1-carboxamide;N-(2-methyl-4-pyridinyl)-1-[4-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]cyclobutane-1-carboxamide is COc1cc(NC(=O)C2(c3ccc(-c4cnc5[nH]ccc5c4)cc3)CCC2)ccn1.Cc1cc(NC(=O)C2(c3ccc(-c4cnc5[nH]ccc5c4)cc3)CCC2)ccn1.Cc1ccc(NC(=O)C2(c3ccc(-c4cnc(N)nc4)cc3)CCOCC2)cc1C#N.Cc1nc(-c2ccc(NC(=O)C3(c4ccc(-c5ccc(N)nc5)cc4)CCOCC3)nc2)cs1.Nc1ncc(-c2ccc(C3(C(=O)Nc4cccc(OCc5ccccc5)c4)CCOCC3)cc2)cn1.

What is the InChIKey of 4-[4-(6-amino-3-pyridinyl)phenyl]-N-[5-(2-methyl-1,3-thiazol-4-yl)-2-pyridinyl]oxane-4-carboxamide;4-[4-(2-aminopyrimidin-5-yl)phenyl]-N-(3-cyano-4-methylphenyl)oxane-4-carboxamide;4-[4-(2-aminopyrimidin-5-yl)phenyl]-N-(3-phenylmethoxyphenyl)oxane-4-carboxamide;N-(2-methoxy-4-pyridinyl)-1-[4-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]cyclobutane-1-carboxamide;N-(2-methyl-4-pyridinyl)-1-[4-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]cyclobutane-1-carboxamide?

The InChIKey is GURCJBVSLSBRBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H28N4O3.C26H25N5O2S.C24H23N5O2.C24H22N4O2.C24H22N4O/c30-28-31-18-23(19-32-28)22-9-11-24(12-10-22)29(13-15-35-16-14-29)27(34)33-25-7-4-8-26(17-25)36-20-21-5-2-1-3-6-21;1-17-30-22(16-34-17)20-5-9-24(29-15-20)31-25(32)26(10-12-33-13-11-26)21-6-2-18(3-7-21)19-4-8-23(27)28-14-19;1-16-2-7-21(12-18(16)13-25)29-22(30)24(8-10-31-11-9-24)20-5-3-17(4-6-20)19-14-27-23(26)28-15-19;1-30-21-14-20(8-12-25-21)28-23(29)24(9-2-10-24)19-5-3-16(4-6-19)18-13-17-7-11-26-22(17)27-15-18;1-16-13-21(8-12-25-16)28-23(29)24(9-2-10-24)20-5-3-17(4-6-20)19-14-18-7-11-26-22(18)27-15-19/h1-12,17-19H,13-16,20H2,(H,33,34)(H2,30,31,32);2-9,14-16H,10-13H2,1H3,(H2,27,28)(H,29,31,32);2-7,12,14-15H,8-11H2,1H3,(H,29,30)(H2,26,27,28);3-8,11-15H,2,9-10H2,1H3,(H,26,27)(H,25,28,29);3-8,11-15H,2,9-10H2,1H3,(H,26,27)(H,25,28,29).

What are the key properties of 4-[4-(6-amino-3-pyridinyl)phenyl]-N-[5-(2-methyl-1,3-thiazol-4-yl)-2-pyridinyl]oxane-4-carboxamide;4-[4-(2-aminopyrimidin-5-yl)phenyl]-N-(3-cyano-4-methylphenyl)oxane-4-carboxamide;4-[4-(2-aminopyrimidin-5-yl)phenyl]-N-(3-phenylmethoxyphenyl)oxane-4-carboxamide;N-(2-methoxy-4-pyridinyl)-1-[4-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]cyclobutane-1-carboxamide;N-(2-methyl-4-pyridinyl)-1-[4-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]cyclobutane-1-carboxamide?

4-[4-(6-amino-3-pyridinyl)phenyl]-N-[5-(2-methyl-1,3-thiazol-4-yl)-2-pyridinyl]oxane-4-carboxamide;4-[4-(2-aminopyrimidin-5-yl)phenyl]-N-(3-cyano-4-methylphenyl)oxane-4-carboxamide;4-[4-(2-aminopyrimidin-5-yl)phenyl]-N-(3-phenylmethoxyphenyl)oxane-4-carboxamide;N-(2-methoxy-4-pyridinyl)-1-[4-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]cyclobutane-1-carboxamide;N-(2-methyl-4-pyridinyl)-1-[4-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]cyclobutane-1-carboxamide has a molecular weight of 2146.57 g/mol, XLogP of 23.12, 25 rotatable bonds, 10 hydrogen bond donors, and 26 hydrogen bond acceptors.

Where does this data come from?

All data for 4-[4-(6-amino-3-pyridinyl)phenyl]-N-[5-(2-methyl-1,3-thiazol-4-yl)-2-pyridinyl]oxane-4-carboxamide;4-[4-(2-aminopyrimidin-5-yl)phenyl]-N-(3-cyano-4-methylphenyl)oxane-4-carboxamide;4-[4-(2-aminopyrimidin-5-yl)phenyl]-N-(3-phenylmethoxyphenyl)oxane-4-carboxamide;N-(2-methoxy-4-pyridinyl)-1-[4-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]cyclobutane-1-carboxamide;N-(2-methyl-4-pyridinyl)-1-[4-(1H-pyrrolo[2,3-b]pyridin-5-yl)phenyl]cyclobutane-1-carboxamide is sourced from PubChem (CID 158371542), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).