N-[2-[2-(dimethylamino)ethyl-methylamino]-4-methoxy-5-[[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-6-yl]amino]phenyl]prop-2-enamide;N-[2-[2-(dimethylamino)ethyl-methylamino]-4-methoxy-5-[[3-(1-methylpyrrol-3-yl)imidazo[1,2-a]pyrazin-6-yl]amino]phenyl]prop-2-enamide;N-[2-[2-(dimethylamino)ethyl-methylamino]-4-methoxy-5-[(3-pyridin-3-ylimidazo[1,2-a]pyrazin-6-yl)amino]phenyl]prop-2-enamide;N-[2-[4-(dimethylamino)piperidin-1-yl]-4-methoxy-5-[[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-6-yl]amino]phenyl]prop-2-enamide

C104H126N34O8 — CID 157170939

About N-[2-[2-(dimethylamino)ethyl-methylamino]-4-methoxy-5-[[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-6-yl]amino]phenyl]prop-2-enamide;N-[2-[2-(dimethylamino)ethyl-methylamino]-4-methoxy-5-[[3-(1-methylpyrrol-3-yl)imidazo[1,2-a]pyrazin-6-yl]amino]phenyl]prop-2-enamide;N-[2-[2-(dimethylamino)ethyl-methylamino]-4-methoxy-5-[(3-pyridin-3-ylimidazo[1,2-a]pyrazin-6-yl)amino]phenyl]prop-2-enamide;N-[2-[4-(dimethylamino)piperidin-1-yl]-4-methoxy-5-[[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-6-yl]amino]phenyl]prop-2-enamide

N-[2-[2-(dimethylamino)ethyl-methylamino]-4-methoxy-5-[[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-6-yl]amino]phenyl]prop-2-enamide;N-[2-[2-(dimethylamino)ethyl-methylamino]-4-methoxy-5-[[3-(1-methylpyrrol-3-yl)imidazo[1,2-a]pyrazin-6-yl]amino]phenyl]prop-2-enamide;N-[2-[2-(dimethylamino)ethyl-methylamino]-4-methoxy-5-[(3-pyridin-3-ylimidazo[1,2-a]pyrazin-6-yl)amino]phenyl]prop-2-enamide;N-[2-[4-(dimethylamino)piperidin-1-yl]-4-methoxy-5-[[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-6-yl]amino]phenyl]prop-2-enamide (PubChem CID 157170939) has the molecular formula C104H126N34O8 and a molecular weight of 1980.38 g/mol. Its IUPAC name is N-[2-[2-(dimethylamino)ethyl-methylamino]-4-methoxy-5-[[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-6-yl]amino]phenyl]prop-2-enamide;N-[2-[2-(dimethylamino)ethyl-methylamino]-4-methoxy-5-[[3-(1-methylpyrrol-3-yl)imidazo[1,2-a]pyrazin-6-yl]amino]phenyl]prop-2-enamide;N-[2-[2-(dimethylamino)ethyl-methylamino]-4-methoxy-5-[(3-pyridin-3-ylimidazo[1,2-a]pyrazin-6-yl)amino]phenyl]prop-2-enamide;N-[2-[4-(dimethylamino)piperidin-1-yl]-4-methoxy-5-[[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-6-yl]amino]phenyl]prop-2-enamide.

Molecular Properties

• Compound Name: N-[2-[2-(dimethylamino)ethyl-methylamino]-4-methoxy-5-[[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-6-yl]amino]phenyl]prop-2-enamide;N-[2-[2-(dimethylamino)ethyl-methylamino]-4-methoxy-5-[[3-(1-methylpyrrol-3-yl)imidazo[1,2-a]pyrazin-6-yl]amino]phenyl]prop-2-enamide;N-[2-[2-(dimethylamino)ethyl-methylamino]-4-methoxy-5-[(3-pyridin-3-ylimidazo[1,2-a]pyrazin-6-yl)amino]phenyl]prop-2-enamide;N-[2-[4-(dimethylamino)piperidin-1-yl]-4-methoxy-5-[[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-6-yl]amino]phenyl]prop-2-enamide
• PubChem CID: 157170939
• Molecular Formula: C104H126N34O8
• Molecular Weight: 1980.38 g/mol
• Exact Mass: 1979.05
• IUPAC Name: N-[2-[2-(dimethylamino)ethyl-methylamino]-4-methoxy-5-[[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-6-yl]amino]phenyl]prop-2-enamide;N-[2-[2-(dimethylamino)ethyl-methylamino]-4-methoxy-5-[[3-(1-methylpyrrol-3-yl)imidazo[1,2-a]pyrazin-6-yl]amino]phenyl]prop-2-enamide;N-[2-[2-(dimethylamino)ethyl-methylamino]-4-methoxy-5-[(3-pyridin-3-ylimidazo[1,2-a]pyrazin-6-yl)amino]phenyl]prop-2-enamide;N-[2-[4-(dimethylamino)piperidin-1-yl]-4-methoxy-5-[[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-6-yl]amino]phenyl]prop-2-enamide
• SMILES: C=CC(=O)Nc1cc(Nc2cn3c(-c4cccnc4)cnc3cn2)c(OC)cc1N(C)CCN(C)C.C=CC(=O)Nc1cc(Nc2cn3c(-c4ccn(C)c4)cnc3cn2)c(OC)cc1N(C)CCN(C)C.C=CC(=O)Nc1cc(Nc2cn3c(-c4cnn(C)c4)cnc3cn2)c(OC)cc1N(C)CCN(C)C.C=CC(=O)Nc1cc(Nc2cn3c(-c4cnn(C)c4)cnc3cn2)c(OC)cc1N1CCC(N(C)C)CC1
• InChI: InChI=1S/C27H33N9O2.C26H32N8O2.C26H30N8O2.C25H31N9O2/c1-6-27(37)32-20-11-21(24(38-5)12-22(20)35-9-7-19(8-10-35)33(2)3)31-25-17-36-23(14-29-26(36)15-28-25)18-13-30-34(4)16-18;1-7-26(35)30-19-12-20(23(36-6)13-21(19)33(5)11-10-31(2)3)29-24-17-34-22(14-28-25(34)15-27-24)18-8-9-32(4)16-18;1-6-26(35)31-19-12-20(23(36-5)13-21(19)33(4)11-10-32(2)3)30-24-17-34-22(15-29-25(34)16-28-24)18-8-7-9-27-14-18;1-7-25(35)30-18-10-19(22(36-6)11-20(18)32(4)9-8-31(2)3)29-23-16-34-21(13-27-24(34)14-26-23)17-12-28-33(5)15-17/h6,11-17,19,31H,1,7-10H2,2-5H3,(H,32,37);7-9,12-17,29H,1,10-11H2,2-6H3,(H,30,35);6-9,12-17,30H,1,10-11H2,2-5H3,(H,31,35);7,10-16,29H,1,8-9H2,2-6H3,(H,30,35)
• InChIKey: ANLMFBIOASBENI-UHFFFAOYSA-N
• XLogP: 13.82
• TPSA: 401.58 Ų
• H-Bond Donors: 8
• H-Bond Acceptors: 38
• Rotatable Bonds: 38
• Heavy Atoms: 146
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1980.38
LogP ≤ 5	13.82
H-Bond Donors ≤ 5	8
H-Bond Acceptors ≤ 10	38

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of N-[2-[2-(dimethylamino)ethyl-methylamino]-4-methoxy-5-[[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-6-yl]amino]phenyl]prop-2-enamide;N-[2-[2-(dimethylamino)ethyl-methylamino]-4-methoxy-5-[[3-(1-methylpyrrol-3-yl)imidazo[1,2-a]pyrazin-6-yl]amino]phenyl]prop-2-enamide;N-[2-[2-(dimethylamino)ethyl-methylamino]-4-methoxy-5-[(3-pyridin-3-ylimidazo[1,2-a]pyrazin-6-yl)amino]phenyl]prop-2-enamide;N-[2-[4-(dimethylamino)piperidin-1-yl]-4-methoxy-5-[[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-6-yl]amino]phenyl]prop-2-enamide?

The IUPAC name of N-[2-[2-(dimethylamino)ethyl-methylamino]-4-methoxy-5-[[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-6-yl]amino]phenyl]prop-2-enamide;N-[2-[2-(dimethylamino)ethyl-methylamino]-4-methoxy-5-[[3-(1-methylpyrrol-3-yl)imidazo[1,2-a]pyrazin-6-yl]amino]phenyl]prop-2-enamide;N-[2-[2-(dimethylamino)ethyl-methylamino]-4-methoxy-5-[(3-pyridin-3-ylimidazo[1,2-a]pyrazin-6-yl)amino]phenyl]prop-2-enamide;N-[2-[4-(dimethylamino)piperidin-1-yl]-4-methoxy-5-[[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-6-yl]amino]phenyl]prop-2-enamide (CID 157170939) is N-[2-[2-(dimethylamino)ethyl-methylamino]-4-methoxy-5-[[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-6-yl]amino]phenyl]prop-2-enamide;N-[2-[2-(dimethylamino)ethyl-methylamino]-4-methoxy-5-[[3-(1-methylpyrrol-3-yl)imidazo[1,2-a]pyrazin-6-yl]amino]phenyl]prop-2-enamide;N-[2-[2-(dimethylamino)ethyl-methylamino]-4-methoxy-5-[(3-pyridin-3-ylimidazo[1,2-a]pyrazin-6-yl)amino]phenyl]prop-2-enamide;N-[2-[4-(dimethylamino)piperidin-1-yl]-4-methoxy-5-[[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-6-yl]amino]phenyl]prop-2-enamide.

What is the SMILES notation for N-[2-[2-(dimethylamino)ethyl-methylamino]-4-methoxy-5-[[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-6-yl]amino]phenyl]prop-2-enamide;N-[2-[2-(dimethylamino)ethyl-methylamino]-4-methoxy-5-[[3-(1-methylpyrrol-3-yl)imidazo[1,2-a]pyrazin-6-yl]amino]phenyl]prop-2-enamide;N-[2-[2-(dimethylamino)ethyl-methylamino]-4-methoxy-5-[(3-pyridin-3-ylimidazo[1,2-a]pyrazin-6-yl)amino]phenyl]prop-2-enamide;N-[2-[4-(dimethylamino)piperidin-1-yl]-4-methoxy-5-[[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-6-yl]amino]phenyl]prop-2-enamide?

The canonical SMILES for N-[2-[2-(dimethylamino)ethyl-methylamino]-4-methoxy-5-[[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-6-yl]amino]phenyl]prop-2-enamide;N-[2-[2-(dimethylamino)ethyl-methylamino]-4-methoxy-5-[[3-(1-methylpyrrol-3-yl)imidazo[1,2-a]pyrazin-6-yl]amino]phenyl]prop-2-enamide;N-[2-[2-(dimethylamino)ethyl-methylamino]-4-methoxy-5-[(3-pyridin-3-ylimidazo[1,2-a]pyrazin-6-yl)amino]phenyl]prop-2-enamide;N-[2-[4-(dimethylamino)piperidin-1-yl]-4-methoxy-5-[[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-6-yl]amino]phenyl]prop-2-enamide is C=CC(=O)Nc1cc(Nc2cn3c(-c4cccnc4)cnc3cn2)c(OC)cc1N(C)CCN(C)C.C=CC(=O)Nc1cc(Nc2cn3c(-c4ccn(C)c4)cnc3cn2)c(OC)cc1N(C)CCN(C)C.C=CC(=O)Nc1cc(Nc2cn3c(-c4cnn(C)c4)cnc3cn2)c(OC)cc1N(C)CCN(C)C.C=CC(=O)Nc1cc(Nc2cn3c(-c4cnn(C)c4)cnc3cn2)c(OC)cc1N1CCC(N(C)C)CC1.

What is the InChIKey of N-[2-[2-(dimethylamino)ethyl-methylamino]-4-methoxy-5-[[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-6-yl]amino]phenyl]prop-2-enamide;N-[2-[2-(dimethylamino)ethyl-methylamino]-4-methoxy-5-[[3-(1-methylpyrrol-3-yl)imidazo[1,2-a]pyrazin-6-yl]amino]phenyl]prop-2-enamide;N-[2-[2-(dimethylamino)ethyl-methylamino]-4-methoxy-5-[(3-pyridin-3-ylimidazo[1,2-a]pyrazin-6-yl)amino]phenyl]prop-2-enamide;N-[2-[4-(dimethylamino)piperidin-1-yl]-4-methoxy-5-[[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-6-yl]amino]phenyl]prop-2-enamide?

The InChIKey is ANLMFBIOASBENI-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H33N9O2.C26H32N8O2.C26H30N8O2.C25H31N9O2/c1-6-27(37)32-20-11-21(24(38-5)12-22(20)35-9-7-19(8-10-35)33(2)3)31-25-17-36-23(14-29-26(36)15-28-25)18-13-30-34(4)16-18;1-7-26(35)30-19-12-20(23(36-6)13-21(19)33(5)11-10-31(2)3)29-24-17-34-22(14-28-25(34)15-27-24)18-8-9-32(4)16-18;1-6-26(35)31-19-12-20(23(36-5)13-21(19)33(4)11-10-32(2)3)30-24-17-34-22(15-29-25(34)16-28-24)18-8-7-9-27-14-18;1-7-25(35)30-18-10-19(22(36-6)11-20(18)32(4)9-8-31(2)3)29-23-16-34-21(13-27-24(34)14-26-23)17-12-28-33(5)15-17/h6,11-17,19,31H,1,7-10H2,2-5H3,(H,32,37);7-9,12-17,29H,1,10-11H2,2-6H3,(H,30,35);6-9,12-17,30H,1,10-11H2,2-5H3,(H,31,35);7,10-16,29H,1,8-9H2,2-6H3,(H,30,35).

What are the key properties of N-[2-[2-(dimethylamino)ethyl-methylamino]-4-methoxy-5-[[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-6-yl]amino]phenyl]prop-2-enamide;N-[2-[2-(dimethylamino)ethyl-methylamino]-4-methoxy-5-[[3-(1-methylpyrrol-3-yl)imidazo[1,2-a]pyrazin-6-yl]amino]phenyl]prop-2-enamide;N-[2-[2-(dimethylamino)ethyl-methylamino]-4-methoxy-5-[(3-pyridin-3-ylimidazo[1,2-a]pyrazin-6-yl)amino]phenyl]prop-2-enamide;N-[2-[4-(dimethylamino)piperidin-1-yl]-4-methoxy-5-[[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-6-yl]amino]phenyl]prop-2-enamide?

N-[2-[2-(dimethylamino)ethyl-methylamino]-4-methoxy-5-[[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-6-yl]amino]phenyl]prop-2-enamide;N-[2-[2-(dimethylamino)ethyl-methylamino]-4-methoxy-5-[[3-(1-methylpyrrol-3-yl)imidazo[1,2-a]pyrazin-6-yl]amino]phenyl]prop-2-enamide;N-[2-[2-(dimethylamino)ethyl-methylamino]-4-methoxy-5-[(3-pyridin-3-ylimidazo[1,2-a]pyrazin-6-yl)amino]phenyl]prop-2-enamide;N-[2-[4-(dimethylamino)piperidin-1-yl]-4-methoxy-5-[[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-6-yl]amino]phenyl]prop-2-enamide has a molecular weight of 1980.38 g/mol, XLogP of 13.82, 38 rotatable bonds, 8 hydrogen bond donors, and 38 hydrogen bond acceptors.

Where does this data come from?

All data for N-[2-[2-(dimethylamino)ethyl-methylamino]-4-methoxy-5-[[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-6-yl]amino]phenyl]prop-2-enamide;N-[2-[2-(dimethylamino)ethyl-methylamino]-4-methoxy-5-[[3-(1-methylpyrrol-3-yl)imidazo[1,2-a]pyrazin-6-yl]amino]phenyl]prop-2-enamide;N-[2-[2-(dimethylamino)ethyl-methylamino]-4-methoxy-5-[(3-pyridin-3-ylimidazo[1,2-a]pyrazin-6-yl)amino]phenyl]prop-2-enamide;N-[2-[4-(dimethylamino)piperidin-1-yl]-4-methoxy-5-[[3-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyrazin-6-yl]amino]phenyl]prop-2-enamide is sourced from PubChem (CID 157170939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).