1-[2-[3-[2-(dimethylamino)ethoxy]anilino]pyrimidin-4-yl]indole-3-carboxamide;1-[2-[(4,6-dimethyl-2-pyridinyl)amino]pyrimidin-4-yl]indole-3-carboxamide;1-[2-[(4-methoxy-2-pyridinyl)amino]pyrimidin-4-yl]indole-3-carboxamide;1-[2-[3-(4-propanoylpiperazin-1-yl)anilino]pyrimidin-4-yl]indole-3-carboxamide;1-[2-[3-(4-prop-2-enoylpiperazin-1-yl)anilino]pyrimidin-4-yl]indole-3-carboxamide;1-[2-(pyridin-2-ylamino)pyrimidin-4-yl]indole-3-carboxamide

C132H124N38O10 — CID 157354125

About 1-[2-[3-[2-(dimethylamino)ethoxy]anilino]pyrimidin-4-yl]indole-3-carboxamide;1-[2-[(4,6-dimethyl-2-pyridinyl)amino]pyrimidin-4-yl]indole-3-carboxamide;1-[2-[(4-methoxy-2-pyridinyl)amino]pyrimidin-4-yl]indole-3-carboxamide;1-[2-[3-(4-propanoylpiperazin-1-yl)anilino]pyrimidin-4-yl]indole-3-carboxamide;1-[2-[3-(4-prop-2-enoylpiperazin-1-yl)anilino]pyrimidin-4-yl]indole-3-carboxamide;1-[2-(pyridin-2-ylamino)pyrimidin-4-yl]indole-3-carboxamide

1-[2-[3-[2-(dimethylamino)ethoxy]anilino]pyrimidin-4-yl]indole-3-carboxamide;1-[2-[(4,6-dimethyl-2-pyridinyl)amino]pyrimidin-4-yl]indole-3-carboxamide;1-[2-[(4-methoxy-2-pyridinyl)amino]pyrimidin-4-yl]indole-3-carboxamide;1-[2-[3-(4-propanoylpiperazin-1-yl)anilino]pyrimidin-4-yl]indole-3-carboxamide;1-[2-[3-(4-prop-2-enoylpiperazin-1-yl)anilino]pyrimidin-4-yl]indole-3-carboxamide;1-[2-(pyridin-2-ylamino)pyrimidin-4-yl]indole-3-carboxamide (PubChem CID 157354125) has the molecular formula C132H124N38O10 and a molecular weight of 2402.70 g/mol. Its IUPAC name is 1-[2-[3-[2-(dimethylamino)ethoxy]anilino]pyrimidin-4-yl]indole-3-carboxamide;1-[2-[(4,6-dimethyl-2-pyridinyl)amino]pyrimidin-4-yl]indole-3-carboxamide;1-[2-[(4-methoxy-2-pyridinyl)amino]pyrimidin-4-yl]indole-3-carboxamide;1-[2-[3-(4-propanoylpiperazin-1-yl)anilino]pyrimidin-4-yl]indole-3-carboxamide;1-[2-[3-(4-prop-2-enoylpiperazin-1-yl)anilino]pyrimidin-4-yl]indole-3-carboxamide;1-[2-(pyridin-2-ylamino)pyrimidin-4-yl]indole-3-carboxamide.

Molecular Properties

• Compound Name: 1-[2-[3-[2-(dimethylamino)ethoxy]anilino]pyrimidin-4-yl]indole-3-carboxamide;1-[2-[(4,6-dimethyl-2-pyridinyl)amino]pyrimidin-4-yl]indole-3-carboxamide;1-[2-[(4-methoxy-2-pyridinyl)amino]pyrimidin-4-yl]indole-3-carboxamide;1-[2-[3-(4-propanoylpiperazin-1-yl)anilino]pyrimidin-4-yl]indole-3-carboxamide;1-[2-[3-(4-prop-2-enoylpiperazin-1-yl)anilino]pyrimidin-4-yl]indole-3-carboxamide;1-[2-(pyridin-2-ylamino)pyrimidin-4-yl]indole-3-carboxamide
• PubChem CID: 157354125
• Molecular Formula: C132H124N38O10
• Molecular Weight: 2402.70 g/mol
• Exact Mass: 2401.04
• IUPAC Name: 1-[2-[3-[2-(dimethylamino)ethoxy]anilino]pyrimidin-4-yl]indole-3-carboxamide;1-[2-[(4,6-dimethyl-2-pyridinyl)amino]pyrimidin-4-yl]indole-3-carboxamide;1-[2-[(4-methoxy-2-pyridinyl)amino]pyrimidin-4-yl]indole-3-carboxamide;1-[2-[3-(4-propanoylpiperazin-1-yl)anilino]pyrimidin-4-yl]indole-3-carboxamide;1-[2-[3-(4-prop-2-enoylpiperazin-1-yl)anilino]pyrimidin-4-yl]indole-3-carboxamide;1-[2-(pyridin-2-ylamino)pyrimidin-4-yl]indole-3-carboxamide
• SMILES: C=CC(=O)N1CCN(c2cccc(Nc3nccc(-n4cc(C(N)=O)c5ccccc54)n3)c2)CC1.CCC(=O)N1CCN(c2cccc(Nc3nccc(-n4cc(C(N)=O)c5ccccc54)n3)c2)CC1.CN(C)CCOc1cccc(Nc2nccc(-n3cc(C(N)=O)c4ccccc43)n2)c1.COc1ccnc(Nc2nccc(-n3cc(C(N)=O)c4ccccc43)n2)c1.Cc1cc(C)nc(Nc2nccc(-n3cc(C(N)=O)c4ccccc43)n2)c1.NC(=O)c1cn(-c2ccnc(Nc3ccccn3)n2)c2ccccc12
• InChI: InChI=1S/C26H27N7O2.C26H25N7O2.C23H24N6O2.C20H18N6O.C19H16N6O2.C18H14N6O/c2*1-2-24(34)32-14-12-31(13-15-32)19-7-5-6-18(16-19)29-26-28-11-10-23(30-26)33-17-21(25(27)35)20-8-3-4-9-22(20)33;1-28(2)12-13-31-17-7-5-6-16(14-17)26-23-25-11-10-21(27-23)29-15-19(22(24)30)18-8-3-4-9-20(18)29;1-12-9-13(2)23-17(10-12)24-20-22-8-7-18(25-20)26-11-15(19(21)27)14-5-3-4-6-16(14)26;1-27-12-6-8-21-16(10-12)23-19-22-9-7-17(24-19)25-11-14(18(20)26)13-4-2-3-5-15(13)25;19-17(25)13-11-24(14-6-2-1-5-12(13)14)16-8-10-21-18(23-16)22-15-7-3-4-9-20-15/h3-11,16-17H,2,12-15H2,1H3,(H2,27,35)(H,28,29,30);2-11,16-17H,1,12-15H2,(H2,27,35)(H,28,29,30);3-11,14-15H,12-13H2,1-2H3,(H2,24,30)(H,25,26,27);3-11H,1-2H3,(H2,21,27)(H,22,23,24,25);2-11H,1H3,(H2,20,26)(H,21,22,23,24);1-11H,(H2,19,25)(H,20,21,22,23)
• InChIKey: BHWLYLHBRRZVNP-UHFFFAOYSA-N
• XLogP: 18.22
• TPSA: 622.45 Ų
• H-Bond Donors: 12
• H-Bond Acceptors: 40
• Rotatable Bonds: 33
• Heavy Atoms: 180
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2402.70
LogP ≤ 5	18.22
H-Bond Donors ≤ 5	12
H-Bond Acceptors ≤ 10	40

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 1-[2-[3-[2-(dimethylamino)ethoxy]anilino]pyrimidin-4-yl]indole-3-carboxamide;1-[2-[(4,6-dimethyl-2-pyridinyl)amino]pyrimidin-4-yl]indole-3-carboxamide;1-[2-[(4-methoxy-2-pyridinyl)amino]pyrimidin-4-yl]indole-3-carboxamide;1-[2-[3-(4-propanoylpiperazin-1-yl)anilino]pyrimidin-4-yl]indole-3-carboxamide;1-[2-[3-(4-prop-2-enoylpiperazin-1-yl)anilino]pyrimidin-4-yl]indole-3-carboxamide;1-[2-(pyridin-2-ylamino)pyrimidin-4-yl]indole-3-carboxamide?

The IUPAC name of 1-[2-[3-[2-(dimethylamino)ethoxy]anilino]pyrimidin-4-yl]indole-3-carboxamide;1-[2-[(4,6-dimethyl-2-pyridinyl)amino]pyrimidin-4-yl]indole-3-carboxamide;1-[2-[(4-methoxy-2-pyridinyl)amino]pyrimidin-4-yl]indole-3-carboxamide;1-[2-[3-(4-propanoylpiperazin-1-yl)anilino]pyrimidin-4-yl]indole-3-carboxamide;1-[2-[3-(4-prop-2-enoylpiperazin-1-yl)anilino]pyrimidin-4-yl]indole-3-carboxamide;1-[2-(pyridin-2-ylamino)pyrimidin-4-yl]indole-3-carboxamide (CID 157354125) is 1-[2-[3-[2-(dimethylamino)ethoxy]anilino]pyrimidin-4-yl]indole-3-carboxamide;1-[2-[(4,6-dimethyl-2-pyridinyl)amino]pyrimidin-4-yl]indole-3-carboxamide;1-[2-[(4-methoxy-2-pyridinyl)amino]pyrimidin-4-yl]indole-3-carboxamide;1-[2-[3-(4-propanoylpiperazin-1-yl)anilino]pyrimidin-4-yl]indole-3-carboxamide;1-[2-[3-(4-prop-2-enoylpiperazin-1-yl)anilino]pyrimidin-4-yl]indole-3-carboxamide;1-[2-(pyridin-2-ylamino)pyrimidin-4-yl]indole-3-carboxamide.

What is the SMILES notation for 1-[2-[3-[2-(dimethylamino)ethoxy]anilino]pyrimidin-4-yl]indole-3-carboxamide;1-[2-[(4,6-dimethyl-2-pyridinyl)amino]pyrimidin-4-yl]indole-3-carboxamide;1-[2-[(4-methoxy-2-pyridinyl)amino]pyrimidin-4-yl]indole-3-carboxamide;1-[2-[3-(4-propanoylpiperazin-1-yl)anilino]pyrimidin-4-yl]indole-3-carboxamide;1-[2-[3-(4-prop-2-enoylpiperazin-1-yl)anilino]pyrimidin-4-yl]indole-3-carboxamide;1-[2-(pyridin-2-ylamino)pyrimidin-4-yl]indole-3-carboxamide?

The canonical SMILES for 1-[2-[3-[2-(dimethylamino)ethoxy]anilino]pyrimidin-4-yl]indole-3-carboxamide;1-[2-[(4,6-dimethyl-2-pyridinyl)amino]pyrimidin-4-yl]indole-3-carboxamide;1-[2-[(4-methoxy-2-pyridinyl)amino]pyrimidin-4-yl]indole-3-carboxamide;1-[2-[3-(4-propanoylpiperazin-1-yl)anilino]pyrimidin-4-yl]indole-3-carboxamide;1-[2-[3-(4-prop-2-enoylpiperazin-1-yl)anilino]pyrimidin-4-yl]indole-3-carboxamide;1-[2-(pyridin-2-ylamino)pyrimidin-4-yl]indole-3-carboxamide is C=CC(=O)N1CCN(c2cccc(Nc3nccc(-n4cc(C(N)=O)c5ccccc54)n3)c2)CC1.CCC(=O)N1CCN(c2cccc(Nc3nccc(-n4cc(C(N)=O)c5ccccc54)n3)c2)CC1.CN(C)CCOc1cccc(Nc2nccc(-n3cc(C(N)=O)c4ccccc43)n2)c1.COc1ccnc(Nc2nccc(-n3cc(C(N)=O)c4ccccc43)n2)c1.Cc1cc(C)nc(Nc2nccc(-n3cc(C(N)=O)c4ccccc43)n2)c1.NC(=O)c1cn(-c2ccnc(Nc3ccccn3)n2)c2ccccc12.

What is the InChIKey of 1-[2-[3-[2-(dimethylamino)ethoxy]anilino]pyrimidin-4-yl]indole-3-carboxamide;1-[2-[(4,6-dimethyl-2-pyridinyl)amino]pyrimidin-4-yl]indole-3-carboxamide;1-[2-[(4-methoxy-2-pyridinyl)amino]pyrimidin-4-yl]indole-3-carboxamide;1-[2-[3-(4-propanoylpiperazin-1-yl)anilino]pyrimidin-4-yl]indole-3-carboxamide;1-[2-[3-(4-prop-2-enoylpiperazin-1-yl)anilino]pyrimidin-4-yl]indole-3-carboxamide;1-[2-(pyridin-2-ylamino)pyrimidin-4-yl]indole-3-carboxamide?

The InChIKey is BHWLYLHBRRZVNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H27N7O2.C26H25N7O2.C23H24N6O2.C20H18N6O.C19H16N6O2.C18H14N6O/c2*1-2-24(34)32-14-12-31(13-15-32)19-7-5-6-18(16-19)29-26-28-11-10-23(30-26)33-17-21(25(27)35)20-8-3-4-9-22(20)33;1-28(2)12-13-31-17-7-5-6-16(14-17)26-23-25-11-10-21(27-23)29-15-19(22(24)30)18-8-3-4-9-20(18)29;1-12-9-13(2)23-17(10-12)24-20-22-8-7-18(25-20)26-11-15(19(21)27)14-5-3-4-6-16(14)26;1-27-12-6-8-21-16(10-12)23-19-22-9-7-17(24-19)25-11-14(18(20)26)13-4-2-3-5-15(13)25;19-17(25)13-11-24(14-6-2-1-5-12(13)14)16-8-10-21-18(23-16)22-15-7-3-4-9-20-15/h3-11,16-17H,2,12-15H2,1H3,(H2,27,35)(H,28,29,30);2-11,16-17H,1,12-15H2,(H2,27,35)(H,28,29,30);3-11,14-15H,12-13H2,1-2H3,(H2,24,30)(H,25,26,27);3-11H,1-2H3,(H2,21,27)(H,22,23,24,25);2-11H,1H3,(H2,20,26)(H,21,22,23,24);1-11H,(H2,19,25)(H,20,21,22,23).

What are the key properties of 1-[2-[3-[2-(dimethylamino)ethoxy]anilino]pyrimidin-4-yl]indole-3-carboxamide;1-[2-[(4,6-dimethyl-2-pyridinyl)amino]pyrimidin-4-yl]indole-3-carboxamide;1-[2-[(4-methoxy-2-pyridinyl)amino]pyrimidin-4-yl]indole-3-carboxamide;1-[2-[3-(4-propanoylpiperazin-1-yl)anilino]pyrimidin-4-yl]indole-3-carboxamide;1-[2-[3-(4-prop-2-enoylpiperazin-1-yl)anilino]pyrimidin-4-yl]indole-3-carboxamide;1-[2-(pyridin-2-ylamino)pyrimidin-4-yl]indole-3-carboxamide?

1-[2-[3-[2-(dimethylamino)ethoxy]anilino]pyrimidin-4-yl]indole-3-carboxamide;1-[2-[(4,6-dimethyl-2-pyridinyl)amino]pyrimidin-4-yl]indole-3-carboxamide;1-[2-[(4-methoxy-2-pyridinyl)amino]pyrimidin-4-yl]indole-3-carboxamide;1-[2-[3-(4-propanoylpiperazin-1-yl)anilino]pyrimidin-4-yl]indole-3-carboxamide;1-[2-[3-(4-prop-2-enoylpiperazin-1-yl)anilino]pyrimidin-4-yl]indole-3-carboxamide;1-[2-(pyridin-2-ylamino)pyrimidin-4-yl]indole-3-carboxamide has a molecular weight of 2402.70 g/mol, XLogP of 18.22, 33 rotatable bonds, 12 hydrogen bond donors, and 40 hydrogen bond acceptors.

Where does this data come from?

All data for 1-[2-[3-[2-(dimethylamino)ethoxy]anilino]pyrimidin-4-yl]indole-3-carboxamide;1-[2-[(4,6-dimethyl-2-pyridinyl)amino]pyrimidin-4-yl]indole-3-carboxamide;1-[2-[(4-methoxy-2-pyridinyl)amino]pyrimidin-4-yl]indole-3-carboxamide;1-[2-[3-(4-propanoylpiperazin-1-yl)anilino]pyrimidin-4-yl]indole-3-carboxamide;1-[2-[3-(4-prop-2-enoylpiperazin-1-yl)anilino]pyrimidin-4-yl]indole-3-carboxamide;1-[2-(pyridin-2-ylamino)pyrimidin-4-yl]indole-3-carboxamide is sourced from PubChem (CID 157354125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).