2-benzyl-5-propan-2-ylpyrazine;2-benzyl-6-propan-2-ylpyrazine;2-[(2-chlorophenyl)methyl]-6-propan-2-ylpyrazine;3-[(2-chlorophenyl)methyl]-6-propan-2-ylpyridazine;3-(cyclohexylmethyl)-6-propan-2-ylpyridazine;2-[(2-methoxyphenyl)methyl]-5-propan-2-ylpyrazine;2-[(2-methoxyphenyl)methyl]-6-propan-2-ylpyrazine;3-[(2-methoxyphenyl)methyl]-6-propan-2-ylpyridazine;N-(2-methoxyphenyl)-5-propan-2-ylpyrazin-2-amine

C129H155Cl2N19O4 — CID 161178611

About 2-benzyl-5-propan-2-ylpyrazine;2-benzyl-6-propan-2-ylpyrazine;2-[(2-chlorophenyl)methyl]-6-propan-2-ylpyrazine;3-[(2-chlorophenyl)methyl]-6-propan-2-ylpyridazine;3-(cyclohexylmethyl)-6-propan-2-ylpyridazine;2-[(2-methoxyphenyl)methyl]-5-propan-2-ylpyrazine;2-[(2-methoxyphenyl)methyl]-6-propan-2-ylpyrazine;3-[(2-methoxyphenyl)methyl]-6-propan-2-ylpyridazine;N-(2-methoxyphenyl)-5-propan-2-ylpyrazin-2-amine

2-benzyl-5-propan-2-ylpyrazine;2-benzyl-6-propan-2-ylpyrazine;2-[(2-chlorophenyl)methyl]-6-propan-2-ylpyrazine;3-[(2-chlorophenyl)methyl]-6-propan-2-ylpyridazine;3-(cyclohexylmethyl)-6-propan-2-ylpyridazine;2-[(2-methoxyphenyl)methyl]-5-propan-2-ylpyrazine;2-[(2-methoxyphenyl)methyl]-6-propan-2-ylpyrazine;3-[(2-methoxyphenyl)methyl]-6-propan-2-ylpyridazine;N-(2-methoxyphenyl)-5-propan-2-ylpyrazin-2-amine (PubChem CID 161178611) has the molecular formula C129H155Cl2N19O4 and a molecular weight of 2106.69 g/mol. Its IUPAC name is 2-benzyl-5-propan-2-ylpyrazine;2-benzyl-6-propan-2-ylpyrazine;2-[(2-chlorophenyl)methyl]-6-propan-2-ylpyrazine;3-[(2-chlorophenyl)methyl]-6-propan-2-ylpyridazine;3-(cyclohexylmethyl)-6-propan-2-ylpyridazine;2-[(2-methoxyphenyl)methyl]-5-propan-2-ylpyrazine;2-[(2-methoxyphenyl)methyl]-6-propan-2-ylpyrazine;3-[(2-methoxyphenyl)methyl]-6-propan-2-ylpyridazine;N-(2-methoxyphenyl)-5-propan-2-ylpyrazin-2-amine.

Molecular Properties

• Compound Name: 2-benzyl-5-propan-2-ylpyrazine;2-benzyl-6-propan-2-ylpyrazine;2-[(2-chlorophenyl)methyl]-6-propan-2-ylpyrazine;3-[(2-chlorophenyl)methyl]-6-propan-2-ylpyridazine;3-(cyclohexylmethyl)-6-propan-2-ylpyridazine;2-[(2-methoxyphenyl)methyl]-5-propan-2-ylpyrazine;2-[(2-methoxyphenyl)methyl]-6-propan-2-ylpyrazine;3-[(2-methoxyphenyl)methyl]-6-propan-2-ylpyridazine;N-(2-methoxyphenyl)-5-propan-2-ylpyrazin-2-amine
• PubChem CID: 161178611
• Molecular Formula: C129H155Cl2N19O4
• Molecular Weight: 2106.69 g/mol
• Exact Mass: 2104.19
• IUPAC Name: 2-benzyl-5-propan-2-ylpyrazine;2-benzyl-6-propan-2-ylpyrazine;2-[(2-chlorophenyl)methyl]-6-propan-2-ylpyrazine;3-[(2-chlorophenyl)methyl]-6-propan-2-ylpyridazine;3-(cyclohexylmethyl)-6-propan-2-ylpyridazine;2-[(2-methoxyphenyl)methyl]-5-propan-2-ylpyrazine;2-[(2-methoxyphenyl)methyl]-6-propan-2-ylpyrazine;3-[(2-methoxyphenyl)methyl]-6-propan-2-ylpyridazine;N-(2-methoxyphenyl)-5-propan-2-ylpyrazin-2-amine
• SMILES: CC(C)c1ccc(CC2CCCCC2)nn1.CC(C)c1ccc(Cc2ccccc2Cl)nn1.CC(C)c1cnc(Cc2ccccc2)cn1.CC(C)c1cncc(Cc2ccccc2)n1.CC(C)c1cncc(Cc2ccccc2Cl)n1.COc1ccccc1Cc1ccc(C(C)C)nn1.COc1ccccc1Cc1cnc(C(C)C)cn1.COc1ccccc1Cc1cncc(C(C)C)n1.COc1ccccc1Nc1cnc(C(C)C)cn1
• InChI: InChI=1S/3C15H18N2O.2C14H15ClN2.C14H17N3O.2C14H16N2.C14H22N2/c1-11(2)14-10-16-13(9-17-14)8-12-6-4-5-7-15(12)18-3;1-11(2)14-10-16-9-13(17-14)8-12-6-4-5-7-15(12)18-3;1-11(2)14-9-8-13(16-17-14)10-12-6-4-5-7-15(12)18-3;1-10(2)14-9-16-8-12(17-14)7-11-5-3-4-6-13(11)15;1-10(2)14-8-7-12(16-17-14)9-11-5-3-4-6-13(11)15;1-10(2)12-8-16-14(9-15-12)17-11-6-4-5-7-13(11)18-3;1-11(2)14-10-15-13(9-16-14)8-12-6-4-3-5-7-12;1-11(2)14-10-15-9-13(16-14)8-12-6-4-3-5-7-12;1-11(2)14-9-8-13(15-16-14)10-12-6-4-3-5-7-12/h2*4-7,9-11H,8H2,1-3H3;4-9,11H,10H2,1-3H3;3-6,8-10H,7H2,1-2H3;3-8,10H,9H2,1-2H3;4-10H,1-3H3,(H,16,17);2*3-7,9-11H,8H2,1-2H3;8-9,11-12H,3-7,10H2,1-2H3
• InChIKey: USDKMOYYOPRYOF-UHFFFAOYSA-N
• XLogP: 30.74
• TPSA: 280.97 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 23
• Rotatable Bonds: 31
• Heavy Atoms: 154
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2106.69
LogP ≤ 5	30.74
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	23

Frequently Asked Questions

What is the IUPAC name of 2-benzyl-5-propan-2-ylpyrazine;2-benzyl-6-propan-2-ylpyrazine;2-[(2-chlorophenyl)methyl]-6-propan-2-ylpyrazine;3-[(2-chlorophenyl)methyl]-6-propan-2-ylpyridazine;3-(cyclohexylmethyl)-6-propan-2-ylpyridazine;2-[(2-methoxyphenyl)methyl]-5-propan-2-ylpyrazine;2-[(2-methoxyphenyl)methyl]-6-propan-2-ylpyrazine;3-[(2-methoxyphenyl)methyl]-6-propan-2-ylpyridazine;N-(2-methoxyphenyl)-5-propan-2-ylpyrazin-2-amine?

The IUPAC name of 2-benzyl-5-propan-2-ylpyrazine;2-benzyl-6-propan-2-ylpyrazine;2-[(2-chlorophenyl)methyl]-6-propan-2-ylpyrazine;3-[(2-chlorophenyl)methyl]-6-propan-2-ylpyridazine;3-(cyclohexylmethyl)-6-propan-2-ylpyridazine;2-[(2-methoxyphenyl)methyl]-5-propan-2-ylpyrazine;2-[(2-methoxyphenyl)methyl]-6-propan-2-ylpyrazine;3-[(2-methoxyphenyl)methyl]-6-propan-2-ylpyridazine;N-(2-methoxyphenyl)-5-propan-2-ylpyrazin-2-amine (CID 161178611) is 2-benzyl-5-propan-2-ylpyrazine;2-benzyl-6-propan-2-ylpyrazine;2-[(2-chlorophenyl)methyl]-6-propan-2-ylpyrazine;3-[(2-chlorophenyl)methyl]-6-propan-2-ylpyridazine;3-(cyclohexylmethyl)-6-propan-2-ylpyridazine;2-[(2-methoxyphenyl)methyl]-5-propan-2-ylpyrazine;2-[(2-methoxyphenyl)methyl]-6-propan-2-ylpyrazine;3-[(2-methoxyphenyl)methyl]-6-propan-2-ylpyridazine;N-(2-methoxyphenyl)-5-propan-2-ylpyrazin-2-amine.

What is the SMILES notation for 2-benzyl-5-propan-2-ylpyrazine;2-benzyl-6-propan-2-ylpyrazine;2-[(2-chlorophenyl)methyl]-6-propan-2-ylpyrazine;3-[(2-chlorophenyl)methyl]-6-propan-2-ylpyridazine;3-(cyclohexylmethyl)-6-propan-2-ylpyridazine;2-[(2-methoxyphenyl)methyl]-5-propan-2-ylpyrazine;2-[(2-methoxyphenyl)methyl]-6-propan-2-ylpyrazine;3-[(2-methoxyphenyl)methyl]-6-propan-2-ylpyridazine;N-(2-methoxyphenyl)-5-propan-2-ylpyrazin-2-amine?

The canonical SMILES for 2-benzyl-5-propan-2-ylpyrazine;2-benzyl-6-propan-2-ylpyrazine;2-[(2-chlorophenyl)methyl]-6-propan-2-ylpyrazine;3-[(2-chlorophenyl)methyl]-6-propan-2-ylpyridazine;3-(cyclohexylmethyl)-6-propan-2-ylpyridazine;2-[(2-methoxyphenyl)methyl]-5-propan-2-ylpyrazine;2-[(2-methoxyphenyl)methyl]-6-propan-2-ylpyrazine;3-[(2-methoxyphenyl)methyl]-6-propan-2-ylpyridazine;N-(2-methoxyphenyl)-5-propan-2-ylpyrazin-2-amine is CC(C)c1ccc(CC2CCCCC2)nn1.CC(C)c1ccc(Cc2ccccc2Cl)nn1.CC(C)c1cnc(Cc2ccccc2)cn1.CC(C)c1cncc(Cc2ccccc2)n1.CC(C)c1cncc(Cc2ccccc2Cl)n1.COc1ccccc1Cc1ccc(C(C)C)nn1.COc1ccccc1Cc1cnc(C(C)C)cn1.COc1ccccc1Cc1cncc(C(C)C)n1.COc1ccccc1Nc1cnc(C(C)C)cn1.

What is the InChIKey of 2-benzyl-5-propan-2-ylpyrazine;2-benzyl-6-propan-2-ylpyrazine;2-[(2-chlorophenyl)methyl]-6-propan-2-ylpyrazine;3-[(2-chlorophenyl)methyl]-6-propan-2-ylpyridazine;3-(cyclohexylmethyl)-6-propan-2-ylpyridazine;2-[(2-methoxyphenyl)methyl]-5-propan-2-ylpyrazine;2-[(2-methoxyphenyl)methyl]-6-propan-2-ylpyrazine;3-[(2-methoxyphenyl)methyl]-6-propan-2-ylpyridazine;N-(2-methoxyphenyl)-5-propan-2-ylpyrazin-2-amine?

The InChIKey is USDKMOYYOPRYOF-UHFFFAOYSA-N. The full InChI is InChI=1S/3C15H18N2O.2C14H15ClN2.C14H17N3O.2C14H16N2.C14H22N2/c1-11(2)14-10-16-13(9-17-14)8-12-6-4-5-7-15(12)18-3;1-11(2)14-10-16-9-13(17-14)8-12-6-4-5-7-15(12)18-3;1-11(2)14-9-8-13(16-17-14)10-12-6-4-5-7-15(12)18-3;1-10(2)14-9-16-8-12(17-14)7-11-5-3-4-6-13(11)15;1-10(2)14-8-7-12(16-17-14)9-11-5-3-4-6-13(11)15;1-10(2)12-8-16-14(9-15-12)17-11-6-4-5-7-13(11)18-3;1-11(2)14-10-15-13(9-16-14)8-12-6-4-3-5-7-12;1-11(2)14-10-15-9-13(16-14)8-12-6-4-3-5-7-12;1-11(2)14-9-8-13(15-16-14)10-12-6-4-3-5-7-12/h2*4-7,9-11H,8H2,1-3H3;4-9,11H,10H2,1-3H3;3-6,8-10H,7H2,1-2H3;3-8,10H,9H2,1-2H3;4-10H,1-3H3,(H,16,17);2*3-7,9-11H,8H2,1-2H3;8-9,11-12H,3-7,10H2,1-2H3.

What are the key properties of 2-benzyl-5-propan-2-ylpyrazine;2-benzyl-6-propan-2-ylpyrazine;2-[(2-chlorophenyl)methyl]-6-propan-2-ylpyrazine;3-[(2-chlorophenyl)methyl]-6-propan-2-ylpyridazine;3-(cyclohexylmethyl)-6-propan-2-ylpyridazine;2-[(2-methoxyphenyl)methyl]-5-propan-2-ylpyrazine;2-[(2-methoxyphenyl)methyl]-6-propan-2-ylpyrazine;3-[(2-methoxyphenyl)methyl]-6-propan-2-ylpyridazine;N-(2-methoxyphenyl)-5-propan-2-ylpyrazin-2-amine?

2-benzyl-5-propan-2-ylpyrazine;2-benzyl-6-propan-2-ylpyrazine;2-[(2-chlorophenyl)methyl]-6-propan-2-ylpyrazine;3-[(2-chlorophenyl)methyl]-6-propan-2-ylpyridazine;3-(cyclohexylmethyl)-6-propan-2-ylpyridazine;2-[(2-methoxyphenyl)methyl]-5-propan-2-ylpyrazine;2-[(2-methoxyphenyl)methyl]-6-propan-2-ylpyrazine;3-[(2-methoxyphenyl)methyl]-6-propan-2-ylpyridazine;N-(2-methoxyphenyl)-5-propan-2-ylpyrazin-2-amine has a molecular weight of 2106.69 g/mol, XLogP of 30.74, 31 rotatable bonds, 1 hydrogen bond donors, and 23 hydrogen bond acceptors.

Where does this data come from?

All data for 2-benzyl-5-propan-2-ylpyrazine;2-benzyl-6-propan-2-ylpyrazine;2-[(2-chlorophenyl)methyl]-6-propan-2-ylpyrazine;3-[(2-chlorophenyl)methyl]-6-propan-2-ylpyridazine;3-(cyclohexylmethyl)-6-propan-2-ylpyridazine;2-[(2-methoxyphenyl)methyl]-5-propan-2-ylpyrazine;2-[(2-methoxyphenyl)methyl]-6-propan-2-ylpyrazine;3-[(2-methoxyphenyl)methyl]-6-propan-2-ylpyridazine;N-(2-methoxyphenyl)-5-propan-2-ylpyrazin-2-amine is sourced from PubChem (CID 161178611), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).