N-[(5-chloro-2,3-dihydro-1-benzofuran-4-yl)methyl]-8-(2,5-dimethylpyrazol-3-yl)-2-methylimidazo[1,2-c]pyrimidin-5-amine;3-chloro-4-[5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]-2-methylimidazo[1,2-c]pyrimidin-8-yl]-N,N-dimethylbenzamide;N-(2,3-dihydro-1-benzofuran-4-ylmethyl)-8-(2,5-dimethylpyrazol-3-yl)-2-methylimidazo[1,2-c]pyrimidin-5-amine

C67H66Cl2FN17O4 — CID 158113589

About N-[(5-chloro-2,3-dihydro-1-benzofuran-4-yl)methyl]-8-(2,5-dimethylpyrazol-3-yl)-2-methylimidazo[1,2-c]pyrimidin-5-amine;3-chloro-4-[5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]-2-methylimidazo[1,2-c]pyrimidin-8-yl]-N,N-dimethylbenzamide;N-(2,3-dihydro-1-benzofuran-4-ylmethyl)-8-(2,5-dimethylpyrazol-3-yl)-2-methylimidazo[1,2-c]pyrimidin-5-amine

N-[(5-chloro-2,3-dihydro-1-benzofuran-4-yl)methyl]-8-(2,5-dimethylpyrazol-3-yl)-2-methylimidazo[1,2-c]pyrimidin-5-amine;3-chloro-4-[5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]-2-methylimidazo[1,2-c]pyrimidin-8-yl]-N,N-dimethylbenzamide;N-(2,3-dihydro-1-benzofuran-4-ylmethyl)-8-(2,5-dimethylpyrazol-3-yl)-2-methylimidazo[1,2-c]pyrimidin-5-amine (PubChem CID 158113589) has the molecular formula C67H66Cl2FN17O4 and a molecular weight of 1263.28 g/mol. Its IUPAC name is N-[(5-chloro-2,3-dihydro-1-benzofuran-4-yl)methyl]-8-(2,5-dimethylpyrazol-3-yl)-2-methylimidazo[1,2-c]pyrimidin-5-amine;3-chloro-4-[5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]-2-methylimidazo[1,2-c]pyrimidin-8-yl]-N,N-dimethylbenzamide;N-(2,3-dihydro-1-benzofuran-4-ylmethyl)-8-(2,5-dimethylpyrazol-3-yl)-2-methylimidazo[1,2-c]pyrimidin-5-amine.

Molecular Properties

• Compound Name: N-[(5-chloro-2,3-dihydro-1-benzofuran-4-yl)methyl]-8-(2,5-dimethylpyrazol-3-yl)-2-methylimidazo[1,2-c]pyrimidin-5-amine;3-chloro-4-[5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]-2-methylimidazo[1,2-c]pyrimidin-8-yl]-N,N-dimethylbenzamide;N-(2,3-dihydro-1-benzofuran-4-ylmethyl)-8-(2,5-dimethylpyrazol-3-yl)-2-methylimidazo[1,2-c]pyrimidin-5-amine
• PubChem CID: 158113589
• Molecular Formula: C67H66Cl2FN17O4
• Molecular Weight: 1263.28 g/mol
• Exact Mass: 1261.48
• IUPAC Name: N-[(5-chloro-2,3-dihydro-1-benzofuran-4-yl)methyl]-8-(2,5-dimethylpyrazol-3-yl)-2-methylimidazo[1,2-c]pyrimidin-5-amine;3-chloro-4-[5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]-2-methylimidazo[1,2-c]pyrimidin-8-yl]-N,N-dimethylbenzamide;N-(2,3-dihydro-1-benzofuran-4-ylmethyl)-8-(2,5-dimethylpyrazol-3-yl)-2-methylimidazo[1,2-c]pyrimidin-5-amine
• SMILES: Cc1cn2c(NCc3c(Cl)ccc4c3CCO4)ncc(-c3cc(C)nn3C)c2n1.Cc1cn2c(NCc3c(F)ccc4c3CCO4)ncc(-c3ccc(C(=O)N(C)C)cc3Cl)c2n1.Cc1cn2c(NCc3cccc4c3CCO4)ncc(-c3cc(C)nn3C)c2n1
• InChI: InChI=1S/C25H23ClFN5O2.C21H21ClN6O.C21H22N6O/c1-14-13-32-23(30-14)19(16-5-4-15(10-20(16)26)24(33)31(2)3)12-29-25(32)28-11-18-17-8-9-34-22(17)7-6-21(18)27;1-12-8-18(27(3)26-12)16-10-24-21(28-11-13(2)25-20(16)28)23-9-15-14-6-7-29-19(14)5-4-17(15)22;1-13-9-18(26(3)25-13)17-11-23-21(27-12-14(2)24-20(17)27)22-10-15-5-4-6-19-16(15)7-8-28-19/h4-7,10,12-13H,8-9,11H2,1-3H3,(H,28,29);4-5,8,10-11H,6-7,9H2,1-3H3,(H,23,24);4-6,9,11-12H,7-8,10H2,1-3H3,(H,22,23)
• InChIKey: FQSRIUQNIZLSNA-UHFFFAOYSA-N
• XLogP: 11.99
• TPSA: 210.30 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 20
• Rotatable Bonds: 13
• Heavy Atoms: 91
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1263.28
LogP ≤ 5	11.99
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	20

Frequently Asked Questions

What is the IUPAC name of N-[(5-chloro-2,3-dihydro-1-benzofuran-4-yl)methyl]-8-(2,5-dimethylpyrazol-3-yl)-2-methylimidazo[1,2-c]pyrimidin-5-amine;3-chloro-4-[5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]-2-methylimidazo[1,2-c]pyrimidin-8-yl]-N,N-dimethylbenzamide;N-(2,3-dihydro-1-benzofuran-4-ylmethyl)-8-(2,5-dimethylpyrazol-3-yl)-2-methylimidazo[1,2-c]pyrimidin-5-amine?

The IUPAC name of N-[(5-chloro-2,3-dihydro-1-benzofuran-4-yl)methyl]-8-(2,5-dimethylpyrazol-3-yl)-2-methylimidazo[1,2-c]pyrimidin-5-amine;3-chloro-4-[5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]-2-methylimidazo[1,2-c]pyrimidin-8-yl]-N,N-dimethylbenzamide;N-(2,3-dihydro-1-benzofuran-4-ylmethyl)-8-(2,5-dimethylpyrazol-3-yl)-2-methylimidazo[1,2-c]pyrimidin-5-amine (CID 158113589) is N-[(5-chloro-2,3-dihydro-1-benzofuran-4-yl)methyl]-8-(2,5-dimethylpyrazol-3-yl)-2-methylimidazo[1,2-c]pyrimidin-5-amine;3-chloro-4-[5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]-2-methylimidazo[1,2-c]pyrimidin-8-yl]-N,N-dimethylbenzamide;N-(2,3-dihydro-1-benzofuran-4-ylmethyl)-8-(2,5-dimethylpyrazol-3-yl)-2-methylimidazo[1,2-c]pyrimidin-5-amine.

What is the SMILES notation for N-[(5-chloro-2,3-dihydro-1-benzofuran-4-yl)methyl]-8-(2,5-dimethylpyrazol-3-yl)-2-methylimidazo[1,2-c]pyrimidin-5-amine;3-chloro-4-[5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]-2-methylimidazo[1,2-c]pyrimidin-8-yl]-N,N-dimethylbenzamide;N-(2,3-dihydro-1-benzofuran-4-ylmethyl)-8-(2,5-dimethylpyrazol-3-yl)-2-methylimidazo[1,2-c]pyrimidin-5-amine?

The canonical SMILES for N-[(5-chloro-2,3-dihydro-1-benzofuran-4-yl)methyl]-8-(2,5-dimethylpyrazol-3-yl)-2-methylimidazo[1,2-c]pyrimidin-5-amine;3-chloro-4-[5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]-2-methylimidazo[1,2-c]pyrimidin-8-yl]-N,N-dimethylbenzamide;N-(2,3-dihydro-1-benzofuran-4-ylmethyl)-8-(2,5-dimethylpyrazol-3-yl)-2-methylimidazo[1,2-c]pyrimidin-5-amine is Cc1cn2c(NCc3c(Cl)ccc4c3CCO4)ncc(-c3cc(C)nn3C)c2n1.Cc1cn2c(NCc3c(F)ccc4c3CCO4)ncc(-c3ccc(C(=O)N(C)C)cc3Cl)c2n1.Cc1cn2c(NCc3cccc4c3CCO4)ncc(-c3cc(C)nn3C)c2n1.

What is the InChIKey of N-[(5-chloro-2,3-dihydro-1-benzofuran-4-yl)methyl]-8-(2,5-dimethylpyrazol-3-yl)-2-methylimidazo[1,2-c]pyrimidin-5-amine;3-chloro-4-[5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]-2-methylimidazo[1,2-c]pyrimidin-8-yl]-N,N-dimethylbenzamide;N-(2,3-dihydro-1-benzofuran-4-ylmethyl)-8-(2,5-dimethylpyrazol-3-yl)-2-methylimidazo[1,2-c]pyrimidin-5-amine?

The InChIKey is FQSRIUQNIZLSNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H23ClFN5O2.C21H21ClN6O.C21H22N6O/c1-14-13-32-23(30-14)19(16-5-4-15(10-20(16)26)24(33)31(2)3)12-29-25(32)28-11-18-17-8-9-34-22(17)7-6-21(18)27;1-12-8-18(27(3)26-12)16-10-24-21(28-11-13(2)25-20(16)28)23-9-15-14-6-7-29-19(14)5-4-17(15)22;1-13-9-18(26(3)25-13)17-11-23-21(27-12-14(2)24-20(17)27)22-10-15-5-4-6-19-16(15)7-8-28-19/h4-7,10,12-13H,8-9,11H2,1-3H3,(H,28,29);4-5,8,10-11H,6-7,9H2,1-3H3,(H,23,24);4-6,9,11-12H,7-8,10H2,1-3H3,(H,22,23).

What are the key properties of N-[(5-chloro-2,3-dihydro-1-benzofuran-4-yl)methyl]-8-(2,5-dimethylpyrazol-3-yl)-2-methylimidazo[1,2-c]pyrimidin-5-amine;3-chloro-4-[5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]-2-methylimidazo[1,2-c]pyrimidin-8-yl]-N,N-dimethylbenzamide;N-(2,3-dihydro-1-benzofuran-4-ylmethyl)-8-(2,5-dimethylpyrazol-3-yl)-2-methylimidazo[1,2-c]pyrimidin-5-amine?

N-[(5-chloro-2,3-dihydro-1-benzofuran-4-yl)methyl]-8-(2,5-dimethylpyrazol-3-yl)-2-methylimidazo[1,2-c]pyrimidin-5-amine;3-chloro-4-[5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]-2-methylimidazo[1,2-c]pyrimidin-8-yl]-N,N-dimethylbenzamide;N-(2,3-dihydro-1-benzofuran-4-ylmethyl)-8-(2,5-dimethylpyrazol-3-yl)-2-methylimidazo[1,2-c]pyrimidin-5-amine has a molecular weight of 1263.28 g/mol, XLogP of 11.99, 13 rotatable bonds, 3 hydrogen bond donors, and 20 hydrogen bond acceptors.

Where does this data come from?

All data for N-[(5-chloro-2,3-dihydro-1-benzofuran-4-yl)methyl]-8-(2,5-dimethylpyrazol-3-yl)-2-methylimidazo[1,2-c]pyrimidin-5-amine;3-chloro-4-[5-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methylamino]-2-methylimidazo[1,2-c]pyrimidin-8-yl]-N,N-dimethylbenzamide;N-(2,3-dihydro-1-benzofuran-4-ylmethyl)-8-(2,5-dimethylpyrazol-3-yl)-2-methylimidazo[1,2-c]pyrimidin-5-amine is sourced from PubChem (CID 158113589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).