tert-butyl N-[1-[7-amino-8-(2,3-dichlorophenyl)imidazo[1,2-c]pyrimidin-5-yl]-4-methylpiperidin-4-yl]carbamate;8-(2-chlorophenyl)sulfanyl-5-(4,4-dimethylpiperidin-1-yl)-7-methylimidazo[1,2-c]pyrimidine;8-(2,3-dichlorophenyl)-5-(4,4-dimethylpiperidin-1-yl)-7-(fluoromethyl)imidazo[1,2-c]pyrimidine;8-(2,3-dichlorophenyl)-5-(4,4-dimethylpiperidin-1-yl)-7-methylimidazo[1,2-a]pyridine;8-(2,3-dichlorophenyl)-5-(4,4-dimethylpiperidin-1-yl)-7-methyl-[1,2,4]triazolo[4,3-a]pyridine;8-(2,3-dichlorophenyl)-5-(4,4-dimethylpiperidin-1-yl)-7-methyl-[1,2,4]triazolo[1,5-c]pyrimidine;8-(2,3-dichlorophenyl)-5-(4,4-dimethylpiperidin-1-yl)-7-methyl-[1,2,4]triazolo[4,3-c]pyrimidine

C142H159Cl13FN31O2S — CID 164975462

About tert-butyl N-[1-[7-amino-8-(2,3-dichlorophenyl)imidazo[1,2-c]pyrimidin-5-yl]-4-methylpiperidin-4-yl]carbamate;8-(2-chlorophenyl)sulfanyl-5-(4,4-dimethylpiperidin-1-yl)-7-methylimidazo[1,2-c]pyrimidine;8-(2,3-dichlorophenyl)-5-(4,4-dimethylpiperidin-1-yl)-7-(fluoromethyl)imidazo[1,2-c]pyrimidine;8-(2,3-dichlorophenyl)-5-(4,4-dimethylpiperidin-1-yl)-7-methylimidazo[1,2-a]pyridine;8-(2,3-dichlorophenyl)-5-(4,4-dimethylpiperidin-1-yl)-7-methyl-[1,2,4]triazolo[4,3-a]pyridine;8-(2,3-dichlorophenyl)-5-(4,4-dimethylpiperidin-1-yl)-7-methyl-[1,2,4]triazolo[1,5-c]pyrimidine;8-(2,3-dichlorophenyl)-5-(4,4-dimethylpiperidin-1-yl)-7-methyl-[1,2,4]triazolo[4,3-c]pyrimidine

tert-butyl N-[1-[7-amino-8-(2,3-dichlorophenyl)imidazo[1,2-c]pyrimidin-5-yl]-4-methylpiperidin-4-yl]carbamate;8-(2-chlorophenyl)sulfanyl-5-(4,4-dimethylpiperidin-1-yl)-7-methylimidazo[1,2-c]pyrimidine;8-(2,3-dichlorophenyl)-5-(4,4-dimethylpiperidin-1-yl)-7-(fluoromethyl)imidazo[1,2-c]pyrimidine;8-(2,3-dichlorophenyl)-5-(4,4-dimethylpiperidin-1-yl)-7-methylimidazo[1,2-a]pyridine;8-(2,3-dichlorophenyl)-5-(4,4-dimethylpiperidin-1-yl)-7-methyl-[1,2,4]triazolo[4,3-a]pyridine;8-(2,3-dichlorophenyl)-5-(4,4-dimethylpiperidin-1-yl)-7-methyl-[1,2,4]triazolo[1,5-c]pyrimidine;8-(2,3-dichlorophenyl)-5-(4,4-dimethylpiperidin-1-yl)-7-methyl-[1,2,4]triazolo[4,3-c]pyrimidine (PubChem CID 164975462) has the molecular formula C142H159Cl13FN31O2S and a molecular weight of 2844.00 g/mol. Its IUPAC name is tert-butyl N-[1-[7-amino-8-(2,3-dichlorophenyl)imidazo[1,2-c]pyrimidin-5-yl]-4-methylpiperidin-4-yl]carbamate;8-(2-chlorophenyl)sulfanyl-5-(4,4-dimethylpiperidin-1-yl)-7-methylimidazo[1,2-c]pyrimidine;8-(2,3-dichlorophenyl)-5-(4,4-dimethylpiperidin-1-yl)-7-(fluoromethyl)imidazo[1,2-c]pyrimidine;8-(2,3-dichlorophenyl)-5-(4,4-dimethylpiperidin-1-yl)-7-methylimidazo[1,2-a]pyridine;8-(2,3-dichlorophenyl)-5-(4,4-dimethylpiperidin-1-yl)-7-methyl-[1,2,4]triazolo[4,3-a]pyridine;8-(2,3-dichlorophenyl)-5-(4,4-dimethylpiperidin-1-yl)-7-methyl-[1,2,4]triazolo[1,5-c]pyrimidine;8-(2,3-dichlorophenyl)-5-(4,4-dimethylpiperidin-1-yl)-7-methyl-[1,2,4]triazolo[4,3-c]pyrimidine.

Molecular Properties

• Compound Name: tert-butyl N-[1-[7-amino-8-(2,3-dichlorophenyl)imidazo[1,2-c]pyrimidin-5-yl]-4-methylpiperidin-4-yl]carbamate;8-(2-chlorophenyl)sulfanyl-5-(4,4-dimethylpiperidin-1-yl)-7-methylimidazo[1,2-c]pyrimidine;8-(2,3-dichlorophenyl)-5-(4,4-dimethylpiperidin-1-yl)-7-(fluoromethyl)imidazo[1,2-c]pyrimidine;8-(2,3-dichlorophenyl)-5-(4,4-dimethylpiperidin-1-yl)-7-methylimidazo[1,2-a]pyridine;8-(2,3-dichlorophenyl)-5-(4,4-dimethylpiperidin-1-yl)-7-methyl-[1,2,4]triazolo[4,3-a]pyridine;8-(2,3-dichlorophenyl)-5-(4,4-dimethylpiperidin-1-yl)-7-methyl-[1,2,4]triazolo[1,5-c]pyrimidine;8-(2,3-dichlorophenyl)-5-(4,4-dimethylpiperidin-1-yl)-7-methyl-[1,2,4]triazolo[4,3-c]pyrimidine
• PubChem CID: 164975462
• Molecular Formula: C142H159Cl13FN31O2S
• Molecular Weight: 2844.00 g/mol
• Exact Mass: 2835.89
• IUPAC Name: tert-butyl N-[1-[7-amino-8-(2,3-dichlorophenyl)imidazo[1,2-c]pyrimidin-5-yl]-4-methylpiperidin-4-yl]carbamate;8-(2-chlorophenyl)sulfanyl-5-(4,4-dimethylpiperidin-1-yl)-7-methylimidazo[1,2-c]pyrimidine;8-(2,3-dichlorophenyl)-5-(4,4-dimethylpiperidin-1-yl)-7-(fluoromethyl)imidazo[1,2-c]pyrimidine;8-(2,3-dichlorophenyl)-5-(4,4-dimethylpiperidin-1-yl)-7-methylimidazo[1,2-a]pyridine;8-(2,3-dichlorophenyl)-5-(4,4-dimethylpiperidin-1-yl)-7-methyl-[1,2,4]triazolo[4,3-a]pyridine;8-(2,3-dichlorophenyl)-5-(4,4-dimethylpiperidin-1-yl)-7-methyl-[1,2,4]triazolo[1,5-c]pyrimidine;8-(2,3-dichlorophenyl)-5-(4,4-dimethylpiperidin-1-yl)-7-methyl-[1,2,4]triazolo[4,3-c]pyrimidine
• SMILES: CC1(C)CCN(c2nc(CF)c(-c3cccc(Cl)c3Cl)c3nccn23)CC1.CC1(NC(=O)OC(C)(C)C)CCN(c2nc(N)c(-c3cccc(Cl)c3Cl)c3nccn23)CC1.Cc1cc(N2CCC(C)(C)CC2)n2ccnc2c1-c1cccc(Cl)c1Cl.Cc1cc(N2CCC(C)(C)CC2)n2cnnc2c1-c1cccc(Cl)c1Cl.Cc1nc(N2CCC(C)(C)CC2)n2ccnc2c1Sc1ccccc1Cl.Cc1nc(N2CCC(C)(C)CC2)n2cnnc2c1-c1cccc(Cl)c1Cl.Cc1nc(N2CCC(C)(C)CC2)n2ncnc2c1-c1cccc(Cl)c1Cl
• InChI: InChI=1S/C23H28Cl2N6O2.C21H23Cl2N3.C20H21Cl2FN4.C20H22Cl2N4.C20H23ClN4S.2C19H21Cl2N5/c1-22(2,3)33-21(32)29-23(4)8-11-30(12-9-23)20-28-18(26)16(19-27-10-13-31(19)20)14-6-5-7-15(24)17(14)25;1-14-13-17(25-10-7-21(2,3)8-11-25)26-12-9-24-20(26)18(14)15-5-4-6-16(22)19(15)23;1-20(2)6-9-26(10-7-20)19-25-15(12-23)16(18-24-8-11-27(18)19)13-4-3-5-14(21)17(13)22;1-13-11-16(25-9-7-20(2,3)8-10-25)26-12-23-24-19(26)17(13)14-5-4-6-15(21)18(14)22;1-14-17(26-16-7-5-4-6-15(16)21)18-22-10-13-25(18)19(23-14)24-11-8-20(2,3)9-12-24;1-12-15(13-5-4-6-14(20)16(13)21)17-24-22-11-26(17)18(23-12)25-9-7-19(2,3)8-10-25;1-12-15(13-5-4-6-14(20)16(13)21)17-22-11-23-26(17)18(24-12)25-9-7-19(2,3)8-10-25/h5-7,10,13H,8-9,11-12,26H2,1-4H3,(H,29,32);4-6,9,12-13H,7-8,10-11H2,1-3H3;3-5,8,11H,6-7,9-10,12H2,1-2H3;4-6,11-12H,7-10H2,1-3H3;4-7,10,13H,8-9,11-12H2,1-3H3;2*4-6,11H,7-10H2,1-3H3
• InChIKey: DSEGVESNKHKQEV-UHFFFAOYSA-N
• XLogP: 38.38
• TPSA: 311.25 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 33
• Rotatable Bonds: 17
• Heavy Atoms: 190
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2844.00
LogP ≤ 5	38.38
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	33

Frequently Asked Questions

What is the IUPAC name of tert-butyl N-[1-[7-amino-8-(2,3-dichlorophenyl)imidazo[1,2-c]pyrimidin-5-yl]-4-methylpiperidin-4-yl]carbamate;8-(2-chlorophenyl)sulfanyl-5-(4,4-dimethylpiperidin-1-yl)-7-methylimidazo[1,2-c]pyrimidine;8-(2,3-dichlorophenyl)-5-(4,4-dimethylpiperidin-1-yl)-7-(fluoromethyl)imidazo[1,2-c]pyrimidine;8-(2,3-dichlorophenyl)-5-(4,4-dimethylpiperidin-1-yl)-7-methylimidazo[1,2-a]pyridine;8-(2,3-dichlorophenyl)-5-(4,4-dimethylpiperidin-1-yl)-7-methyl-[1,2,4]triazolo[4,3-a]pyridine;8-(2,3-dichlorophenyl)-5-(4,4-dimethylpiperidin-1-yl)-7-methyl-[1,2,4]triazolo[1,5-c]pyrimidine;8-(2,3-dichlorophenyl)-5-(4,4-dimethylpiperidin-1-yl)-7-methyl-[1,2,4]triazolo[4,3-c]pyrimidine?

The IUPAC name of tert-butyl N-[1-[7-amino-8-(2,3-dichlorophenyl)imidazo[1,2-c]pyrimidin-5-yl]-4-methylpiperidin-4-yl]carbamate;8-(2-chlorophenyl)sulfanyl-5-(4,4-dimethylpiperidin-1-yl)-7-methylimidazo[1,2-c]pyrimidine;8-(2,3-dichlorophenyl)-5-(4,4-dimethylpiperidin-1-yl)-7-(fluoromethyl)imidazo[1,2-c]pyrimidine;8-(2,3-dichlorophenyl)-5-(4,4-dimethylpiperidin-1-yl)-7-methylimidazo[1,2-a]pyridine;8-(2,3-dichlorophenyl)-5-(4,4-dimethylpiperidin-1-yl)-7-methyl-[1,2,4]triazolo[4,3-a]pyridine;8-(2,3-dichlorophenyl)-5-(4,4-dimethylpiperidin-1-yl)-7-methyl-[1,2,4]triazolo[1,5-c]pyrimidine;8-(2,3-dichlorophenyl)-5-(4,4-dimethylpiperidin-1-yl)-7-methyl-[1,2,4]triazolo[4,3-c]pyrimidine (CID 164975462) is tert-butyl N-[1-[7-amino-8-(2,3-dichlorophenyl)imidazo[1,2-c]pyrimidin-5-yl]-4-methylpiperidin-4-yl]carbamate;8-(2-chlorophenyl)sulfanyl-5-(4,4-dimethylpiperidin-1-yl)-7-methylimidazo[1,2-c]pyrimidine;8-(2,3-dichlorophenyl)-5-(4,4-dimethylpiperidin-1-yl)-7-(fluoromethyl)imidazo[1,2-c]pyrimidine;8-(2,3-dichlorophenyl)-5-(4,4-dimethylpiperidin-1-yl)-7-methylimidazo[1,2-a]pyridine;8-(2,3-dichlorophenyl)-5-(4,4-dimethylpiperidin-1-yl)-7-methyl-[1,2,4]triazolo[4,3-a]pyridine;8-(2,3-dichlorophenyl)-5-(4,4-dimethylpiperidin-1-yl)-7-methyl-[1,2,4]triazolo[1,5-c]pyrimidine;8-(2,3-dichlorophenyl)-5-(4,4-dimethylpiperidin-1-yl)-7-methyl-[1,2,4]triazolo[4,3-c]pyrimidine.

What is the SMILES notation for tert-butyl N-[1-[7-amino-8-(2,3-dichlorophenyl)imidazo[1,2-c]pyrimidin-5-yl]-4-methylpiperidin-4-yl]carbamate;8-(2-chlorophenyl)sulfanyl-5-(4,4-dimethylpiperidin-1-yl)-7-methylimidazo[1,2-c]pyrimidine;8-(2,3-dichlorophenyl)-5-(4,4-dimethylpiperidin-1-yl)-7-(fluoromethyl)imidazo[1,2-c]pyrimidine;8-(2,3-dichlorophenyl)-5-(4,4-dimethylpiperidin-1-yl)-7-methylimidazo[1,2-a]pyridine;8-(2,3-dichlorophenyl)-5-(4,4-dimethylpiperidin-1-yl)-7-methyl-[1,2,4]triazolo[4,3-a]pyridine;8-(2,3-dichlorophenyl)-5-(4,4-dimethylpiperidin-1-yl)-7-methyl-[1,2,4]triazolo[1,5-c]pyrimidine;8-(2,3-dichlorophenyl)-5-(4,4-dimethylpiperidin-1-yl)-7-methyl-[1,2,4]triazolo[4,3-c]pyrimidine?

The canonical SMILES for tert-butyl N-[1-[7-amino-8-(2,3-dichlorophenyl)imidazo[1,2-c]pyrimidin-5-yl]-4-methylpiperidin-4-yl]carbamate;8-(2-chlorophenyl)sulfanyl-5-(4,4-dimethylpiperidin-1-yl)-7-methylimidazo[1,2-c]pyrimidine;8-(2,3-dichlorophenyl)-5-(4,4-dimethylpiperidin-1-yl)-7-(fluoromethyl)imidazo[1,2-c]pyrimidine;8-(2,3-dichlorophenyl)-5-(4,4-dimethylpiperidin-1-yl)-7-methylimidazo[1,2-a]pyridine;8-(2,3-dichlorophenyl)-5-(4,4-dimethylpiperidin-1-yl)-7-methyl-[1,2,4]triazolo[4,3-a]pyridine;8-(2,3-dichlorophenyl)-5-(4,4-dimethylpiperidin-1-yl)-7-methyl-[1,2,4]triazolo[1,5-c]pyrimidine;8-(2,3-dichlorophenyl)-5-(4,4-dimethylpiperidin-1-yl)-7-methyl-[1,2,4]triazolo[4,3-c]pyrimidine is CC1(C)CCN(c2nc(CF)c(-c3cccc(Cl)c3Cl)c3nccn23)CC1.CC1(NC(=O)OC(C)(C)C)CCN(c2nc(N)c(-c3cccc(Cl)c3Cl)c3nccn23)CC1.Cc1cc(N2CCC(C)(C)CC2)n2ccnc2c1-c1cccc(Cl)c1Cl.Cc1cc(N2CCC(C)(C)CC2)n2cnnc2c1-c1cccc(Cl)c1Cl.Cc1nc(N2CCC(C)(C)CC2)n2ccnc2c1Sc1ccccc1Cl.Cc1nc(N2CCC(C)(C)CC2)n2cnnc2c1-c1cccc(Cl)c1Cl.Cc1nc(N2CCC(C)(C)CC2)n2ncnc2c1-c1cccc(Cl)c1Cl.

What is the InChIKey of tert-butyl N-[1-[7-amino-8-(2,3-dichlorophenyl)imidazo[1,2-c]pyrimidin-5-yl]-4-methylpiperidin-4-yl]carbamate;8-(2-chlorophenyl)sulfanyl-5-(4,4-dimethylpiperidin-1-yl)-7-methylimidazo[1,2-c]pyrimidine;8-(2,3-dichlorophenyl)-5-(4,4-dimethylpiperidin-1-yl)-7-(fluoromethyl)imidazo[1,2-c]pyrimidine;8-(2,3-dichlorophenyl)-5-(4,4-dimethylpiperidin-1-yl)-7-methylimidazo[1,2-a]pyridine;8-(2,3-dichlorophenyl)-5-(4,4-dimethylpiperidin-1-yl)-7-methyl-[1,2,4]triazolo[4,3-a]pyridine;8-(2,3-dichlorophenyl)-5-(4,4-dimethylpiperidin-1-yl)-7-methyl-[1,2,4]triazolo[1,5-c]pyrimidine;8-(2,3-dichlorophenyl)-5-(4,4-dimethylpiperidin-1-yl)-7-methyl-[1,2,4]triazolo[4,3-c]pyrimidine?

The InChIKey is DSEGVESNKHKQEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H28Cl2N6O2.C21H23Cl2N3.C20H21Cl2FN4.C20H22Cl2N4.C20H23ClN4S.2C19H21Cl2N5/c1-22(2,3)33-21(32)29-23(4)8-11-30(12-9-23)20-28-18(26)16(19-27-10-13-31(19)20)14-6-5-7-15(24)17(14)25;1-14-13-17(25-10-7-21(2,3)8-11-25)26-12-9-24-20(26)18(14)15-5-4-6-16(22)19(15)23;1-20(2)6-9-26(10-7-20)19-25-15(12-23)16(18-24-8-11-27(18)19)13-4-3-5-14(21)17(13)22;1-13-11-16(25-9-7-20(2,3)8-10-25)26-12-23-24-19(26)17(13)14-5-4-6-15(21)18(14)22;1-14-17(26-16-7-5-4-6-15(16)21)18-22-10-13-25(18)19(23-14)24-11-8-20(2,3)9-12-24;1-12-15(13-5-4-6-14(20)16(13)21)17-24-22-11-26(17)18(23-12)25-9-7-19(2,3)8-10-25;1-12-15(13-5-4-6-14(20)16(13)21)17-22-11-23-26(17)18(24-12)25-9-7-19(2,3)8-10-25/h5-7,10,13H,8-9,11-12,26H2,1-4H3,(H,29,32);4-6,9,12-13H,7-8,10-11H2,1-3H3;3-5,8,11H,6-7,9-10,12H2,1-2H3;4-6,11-12H,7-10H2,1-3H3;4-7,10,13H,8-9,11-12H2,1-3H3;2*4-6,11H,7-10H2,1-3H3.

What are the key properties of tert-butyl N-[1-[7-amino-8-(2,3-dichlorophenyl)imidazo[1,2-c]pyrimidin-5-yl]-4-methylpiperidin-4-yl]carbamate;8-(2-chlorophenyl)sulfanyl-5-(4,4-dimethylpiperidin-1-yl)-7-methylimidazo[1,2-c]pyrimidine;8-(2,3-dichlorophenyl)-5-(4,4-dimethylpiperidin-1-yl)-7-(fluoromethyl)imidazo[1,2-c]pyrimidine;8-(2,3-dichlorophenyl)-5-(4,4-dimethylpiperidin-1-yl)-7-methylimidazo[1,2-a]pyridine;8-(2,3-dichlorophenyl)-5-(4,4-dimethylpiperidin-1-yl)-7-methyl-[1,2,4]triazolo[4,3-a]pyridine;8-(2,3-dichlorophenyl)-5-(4,4-dimethylpiperidin-1-yl)-7-methyl-[1,2,4]triazolo[1,5-c]pyrimidine;8-(2,3-dichlorophenyl)-5-(4,4-dimethylpiperidin-1-yl)-7-methyl-[1,2,4]triazolo[4,3-c]pyrimidine?

tert-butyl N-[1-[7-amino-8-(2,3-dichlorophenyl)imidazo[1,2-c]pyrimidin-5-yl]-4-methylpiperidin-4-yl]carbamate;8-(2-chlorophenyl)sulfanyl-5-(4,4-dimethylpiperidin-1-yl)-7-methylimidazo[1,2-c]pyrimidine;8-(2,3-dichlorophenyl)-5-(4,4-dimethylpiperidin-1-yl)-7-(fluoromethyl)imidazo[1,2-c]pyrimidine;8-(2,3-dichlorophenyl)-5-(4,4-dimethylpiperidin-1-yl)-7-methylimidazo[1,2-a]pyridine;8-(2,3-dichlorophenyl)-5-(4,4-dimethylpiperidin-1-yl)-7-methyl-[1,2,4]triazolo[4,3-a]pyridine;8-(2,3-dichlorophenyl)-5-(4,4-dimethylpiperidin-1-yl)-7-methyl-[1,2,4]triazolo[1,5-c]pyrimidine;8-(2,3-dichlorophenyl)-5-(4,4-dimethylpiperidin-1-yl)-7-methyl-[1,2,4]triazolo[4,3-c]pyrimidine has a molecular weight of 2844.00 g/mol, XLogP of 38.38, 17 rotatable bonds, 2 hydrogen bond donors, and 33 hydrogen bond acceptors.

Where does this data come from?

All data for tert-butyl N-[1-[7-amino-8-(2,3-dichlorophenyl)imidazo[1,2-c]pyrimidin-5-yl]-4-methylpiperidin-4-yl]carbamate;8-(2-chlorophenyl)sulfanyl-5-(4,4-dimethylpiperidin-1-yl)-7-methylimidazo[1,2-c]pyrimidine;8-(2,3-dichlorophenyl)-5-(4,4-dimethylpiperidin-1-yl)-7-(fluoromethyl)imidazo[1,2-c]pyrimidine;8-(2,3-dichlorophenyl)-5-(4,4-dimethylpiperidin-1-yl)-7-methylimidazo[1,2-a]pyridine;8-(2,3-dichlorophenyl)-5-(4,4-dimethylpiperidin-1-yl)-7-methyl-[1,2,4]triazolo[4,3-a]pyridine;8-(2,3-dichlorophenyl)-5-(4,4-dimethylpiperidin-1-yl)-7-methyl-[1,2,4]triazolo[1,5-c]pyrimidine;8-(2,3-dichlorophenyl)-5-(4,4-dimethylpiperidin-1-yl)-7-methyl-[1,2,4]triazolo[4,3-c]pyrimidine is sourced from PubChem (CID 164975462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).