2-[4-[2-methyl-5-[(5-methyl-1H-pyrazol-3-yl)amino]imidazo[1,2-c]pyrimidin-7-yl]pyrazol-1-yl]-N-phenylacetamide;2-methyl-N-(5-methyl-1H-pyrazol-3-yl)-7-[1-(1-phenylpropan-2-yl)pyrazol-4-yl]imidazo[1,2-c]pyrimidin-5-amine

C45H45N17O — CID 69401888

About 2-[4-[2-methyl-5-[(5-methyl-1H-pyrazol-3-yl)amino]imidazo[1,2-c]pyrimidin-7-yl]pyrazol-1-yl]-N-phenylacetamide;2-methyl-N-(5-methyl-1H-pyrazol-3-yl)-7-[1-(1-phenylpropan-2-yl)pyrazol-4-yl]imidazo[1,2-c]pyrimidin-5-amine

2-[4-[2-methyl-5-[(5-methyl-1H-pyrazol-3-yl)amino]imidazo[1,2-c]pyrimidin-7-yl]pyrazol-1-yl]-N-phenylacetamide;2-methyl-N-(5-methyl-1H-pyrazol-3-yl)-7-[1-(1-phenylpropan-2-yl)pyrazol-4-yl]imidazo[1,2-c]pyrimidin-5-amine (PubChem CID 69401888) has the molecular formula C45H45N17O and a molecular weight of 839.97 g/mol. Its IUPAC name is 2-[4-[2-methyl-5-[(5-methyl-1H-pyrazol-3-yl)amino]imidazo[1,2-c]pyrimidin-7-yl]pyrazol-1-yl]-N-phenylacetamide;2-methyl-N-(5-methyl-1H-pyrazol-3-yl)-7-[1-(1-phenylpropan-2-yl)pyrazol-4-yl]imidazo[1,2-c]pyrimidin-5-amine.

Molecular Properties

• Compound Name: 2-[4-[2-methyl-5-[(5-methyl-1H-pyrazol-3-yl)amino]imidazo[1,2-c]pyrimidin-7-yl]pyrazol-1-yl]-N-phenylacetamide;2-methyl-N-(5-methyl-1H-pyrazol-3-yl)-7-[1-(1-phenylpropan-2-yl)pyrazol-4-yl]imidazo[1,2-c]pyrimidin-5-amine
• PubChem CID: 69401888
• Molecular Formula: C45H45N17O
• Molecular Weight: 839.97 g/mol
• Exact Mass: 839.40
• IUPAC Name: 2-[4-[2-methyl-5-[(5-methyl-1H-pyrazol-3-yl)amino]imidazo[1,2-c]pyrimidin-7-yl]pyrazol-1-yl]-N-phenylacetamide;2-methyl-N-(5-methyl-1H-pyrazol-3-yl)-7-[1-(1-phenylpropan-2-yl)pyrazol-4-yl]imidazo[1,2-c]pyrimidin-5-amine
• SMILES: Cc1cn2c(Nc3cc(C)[nH]n3)nc(-c3cnn(C(C)Cc4ccccc4)c3)cc2n1.Cc1cn2c(Nc3cc(C)[nH]n3)nc(-c3cnn(CC(=O)Nc4ccccc4)c3)cc2n1
• InChI: InChI=1S/C23H24N8.C22H21N9O/c1-15-9-21(29-28-15)27-23-26-20(11-22-25-16(2)13-30(22)23)19-12-24-31(14-19)17(3)10-18-7-5-4-6-8-18;1-14-8-19(29-28-14)27-22-26-18(9-20-24-15(2)11-31(20)22)16-10-23-30(12-16)13-21(32)25-17-6-4-3-5-7-17/h4-9,11-14,17H,10H2,1-3H3,(H2,26,27,28,29);3-12H,13H2,1-2H3,(H,25,32)(H2,26,27,28,29)
• InChIKey: JCQSRALVHFKTQZ-UHFFFAOYSA-N
• XLogP: 7.80
• TPSA: 206.54 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 15
• Rotatable Bonds: 12
• Heavy Atoms: 63
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	839.97
LogP ≤ 5	7.80
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	15

Frequently Asked Questions

What is the IUPAC name of 2-[4-[2-methyl-5-[(5-methyl-1H-pyrazol-3-yl)amino]imidazo[1,2-c]pyrimidin-7-yl]pyrazol-1-yl]-N-phenylacetamide;2-methyl-N-(5-methyl-1H-pyrazol-3-yl)-7-[1-(1-phenylpropan-2-yl)pyrazol-4-yl]imidazo[1,2-c]pyrimidin-5-amine?

The IUPAC name of 2-[4-[2-methyl-5-[(5-methyl-1H-pyrazol-3-yl)amino]imidazo[1,2-c]pyrimidin-7-yl]pyrazol-1-yl]-N-phenylacetamide;2-methyl-N-(5-methyl-1H-pyrazol-3-yl)-7-[1-(1-phenylpropan-2-yl)pyrazol-4-yl]imidazo[1,2-c]pyrimidin-5-amine (CID 69401888) is 2-[4-[2-methyl-5-[(5-methyl-1H-pyrazol-3-yl)amino]imidazo[1,2-c]pyrimidin-7-yl]pyrazol-1-yl]-N-phenylacetamide;2-methyl-N-(5-methyl-1H-pyrazol-3-yl)-7-[1-(1-phenylpropan-2-yl)pyrazol-4-yl]imidazo[1,2-c]pyrimidin-5-amine.

What is the SMILES notation for 2-[4-[2-methyl-5-[(5-methyl-1H-pyrazol-3-yl)amino]imidazo[1,2-c]pyrimidin-7-yl]pyrazol-1-yl]-N-phenylacetamide;2-methyl-N-(5-methyl-1H-pyrazol-3-yl)-7-[1-(1-phenylpropan-2-yl)pyrazol-4-yl]imidazo[1,2-c]pyrimidin-5-amine?

The canonical SMILES for 2-[4-[2-methyl-5-[(5-methyl-1H-pyrazol-3-yl)amino]imidazo[1,2-c]pyrimidin-7-yl]pyrazol-1-yl]-N-phenylacetamide;2-methyl-N-(5-methyl-1H-pyrazol-3-yl)-7-[1-(1-phenylpropan-2-yl)pyrazol-4-yl]imidazo[1,2-c]pyrimidin-5-amine is Cc1cn2c(Nc3cc(C)[nH]n3)nc(-c3cnn(C(C)Cc4ccccc4)c3)cc2n1.Cc1cn2c(Nc3cc(C)[nH]n3)nc(-c3cnn(CC(=O)Nc4ccccc4)c3)cc2n1.

What is the InChIKey of 2-[4-[2-methyl-5-[(5-methyl-1H-pyrazol-3-yl)amino]imidazo[1,2-c]pyrimidin-7-yl]pyrazol-1-yl]-N-phenylacetamide;2-methyl-N-(5-methyl-1H-pyrazol-3-yl)-7-[1-(1-phenylpropan-2-yl)pyrazol-4-yl]imidazo[1,2-c]pyrimidin-5-amine?

The InChIKey is JCQSRALVHFKTQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N8.C22H21N9O/c1-15-9-21(29-28-15)27-23-26-20(11-22-25-16(2)13-30(22)23)19-12-24-31(14-19)17(3)10-18-7-5-4-6-8-18;1-14-8-19(29-28-14)27-22-26-18(9-20-24-15(2)11-31(20)22)16-10-23-30(12-16)13-21(32)25-17-6-4-3-5-7-17/h4-9,11-14,17H,10H2,1-3H3,(H2,26,27,28,29);3-12H,13H2,1-2H3,(H,25,32)(H2,26,27,28,29).

What are the key properties of 2-[4-[2-methyl-5-[(5-methyl-1H-pyrazol-3-yl)amino]imidazo[1,2-c]pyrimidin-7-yl]pyrazol-1-yl]-N-phenylacetamide;2-methyl-N-(5-methyl-1H-pyrazol-3-yl)-7-[1-(1-phenylpropan-2-yl)pyrazol-4-yl]imidazo[1,2-c]pyrimidin-5-amine?

2-[4-[2-methyl-5-[(5-methyl-1H-pyrazol-3-yl)amino]imidazo[1,2-c]pyrimidin-7-yl]pyrazol-1-yl]-N-phenylacetamide;2-methyl-N-(5-methyl-1H-pyrazol-3-yl)-7-[1-(1-phenylpropan-2-yl)pyrazol-4-yl]imidazo[1,2-c]pyrimidin-5-amine has a molecular weight of 839.97 g/mol, XLogP of 7.80, 12 rotatable bonds, 5 hydrogen bond donors, and 15 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[4-[2-methyl-5-[(5-methyl-1H-pyrazol-3-yl)amino]imidazo[1,2-c]pyrimidin-7-yl]pyrazol-1-yl]-N-phenylacetamide;2-methyl-N-(5-methyl-1H-pyrazol-3-yl)-7-[1-(1-phenylpropan-2-yl)pyrazol-4-yl]imidazo[1,2-c]pyrimidin-5-amine is sourced from PubChem (CID 69401888), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).