methyl 7-amino-2-[2-fluoro-3-(2-methyl-1,3-oxazol-5-yl)phenyl]-1H-pyrrolo[2,3-c]pyridine-4-carboxylate;methyl 7-bromo-2-[2-fluoro-3-(2-methyl-1,3-oxazol-5-yl)phenyl]-1H-pyrrolo[2,3-c]pyridine-4-carboxylate;methyl 7-(dibenzylamino)-2-[2-fluoro-3-(2-methyl-1,3-oxazol-5-yl)phenyl]-1H-pyrrolo[2,3-c]pyridine-4-carboxylate;1-methylpyrazol-3-amine

C75H62BrF3N14O9 — CID 164996330

About methyl 7-amino-2-[2-fluoro-3-(2-methyl-1,3-oxazol-5-yl)phenyl]-1H-pyrrolo[2,3-c]pyridine-4-carboxylate;methyl 7-bromo-2-[2-fluoro-3-(2-methyl-1,3-oxazol-5-yl)phenyl]-1H-pyrrolo[2,3-c]pyridine-4-carboxylate;methyl 7-(dibenzylamino)-2-[2-fluoro-3-(2-methyl-1,3-oxazol-5-yl)phenyl]-1H-pyrrolo[2,3-c]pyridine-4-carboxylate;1-methylpyrazol-3-amine

methyl 7-amino-2-[2-fluoro-3-(2-methyl-1,3-oxazol-5-yl)phenyl]-1H-pyrrolo[2,3-c]pyridine-4-carboxylate;methyl 7-bromo-2-[2-fluoro-3-(2-methyl-1,3-oxazol-5-yl)phenyl]-1H-pyrrolo[2,3-c]pyridine-4-carboxylate;methyl 7-(dibenzylamino)-2-[2-fluoro-3-(2-methyl-1,3-oxazol-5-yl)phenyl]-1H-pyrrolo[2,3-c]pyridine-4-carboxylate;1-methylpyrazol-3-amine (PubChem CID 164996330) has the molecular formula C75H62BrF3N14O9 and a molecular weight of 1440.31 g/mol. Its IUPAC name is methyl 7-amino-2-[2-fluoro-3-(2-methyl-1,3-oxazol-5-yl)phenyl]-1H-pyrrolo[2,3-c]pyridine-4-carboxylate;methyl 7-bromo-2-[2-fluoro-3-(2-methyl-1,3-oxazol-5-yl)phenyl]-1H-pyrrolo[2,3-c]pyridine-4-carboxylate;methyl 7-(dibenzylamino)-2-[2-fluoro-3-(2-methyl-1,3-oxazol-5-yl)phenyl]-1H-pyrrolo[2,3-c]pyridine-4-carboxylate;1-methylpyrazol-3-amine.

Molecular Properties

• Compound Name: methyl 7-amino-2-[2-fluoro-3-(2-methyl-1,3-oxazol-5-yl)phenyl]-1H-pyrrolo[2,3-c]pyridine-4-carboxylate;methyl 7-bromo-2-[2-fluoro-3-(2-methyl-1,3-oxazol-5-yl)phenyl]-1H-pyrrolo[2,3-c]pyridine-4-carboxylate;methyl 7-(dibenzylamino)-2-[2-fluoro-3-(2-methyl-1,3-oxazol-5-yl)phenyl]-1H-pyrrolo[2,3-c]pyridine-4-carboxylate;1-methylpyrazol-3-amine
• PubChem CID: 164996330
• Molecular Formula: C75H62BrF3N14O9
• Molecular Weight: 1440.31 g/mol
• Exact Mass: 1438.40
• IUPAC Name: methyl 7-amino-2-[2-fluoro-3-(2-methyl-1,3-oxazol-5-yl)phenyl]-1H-pyrrolo[2,3-c]pyridine-4-carboxylate;methyl 7-bromo-2-[2-fluoro-3-(2-methyl-1,3-oxazol-5-yl)phenyl]-1H-pyrrolo[2,3-c]pyridine-4-carboxylate;methyl 7-(dibenzylamino)-2-[2-fluoro-3-(2-methyl-1,3-oxazol-5-yl)phenyl]-1H-pyrrolo[2,3-c]pyridine-4-carboxylate;1-methylpyrazol-3-amine
• SMILES: COC(=O)c1cnc(Br)c2[nH]c(-c3cccc(-c4cnc(C)o4)c3F)cc12.COC(=O)c1cnc(N(Cc2ccccc2)Cc2ccccc2)c2[nH]c(-c3cccc(-c4cnc(C)o4)c3F)cc12.COC(=O)c1cnc(N)c2[nH]c(-c3cccc(-c4cnc(C)o4)c3F)cc12.Cn1ccc(N)n1
• InChI: InChI=1S/C33H27FN4O3.C19H13BrFN3O3.C19H15FN4O3.C4H7N3/c1-21-35-18-29(41-21)25-15-9-14-24(30(25)34)28-16-26-27(33(39)40-2)17-36-32(31(26)37-28)38(19-22-10-5-3-6-11-22)20-23-12-7-4-8-13-23;1-9-22-8-15(27-9)11-5-3-4-10(16(11)21)14-6-12-13(19(25)26-2)7-23-18(20)17(12)24-14;1-9-22-8-15(27-9)11-5-3-4-10(16(11)20)14-6-12-13(19(25)26-2)7-23-18(21)17(12)24-14;1-7-3-2-4(5)6-7/h3-18,37H,19-20H2,1-2H3;3-8,24H,1-2H3;3-8,24H,1-2H3,(H2,21,23);2-3H,1H3,(H2,5,6)
• InChIKey: HPKYOMLEMPHYIF-UHFFFAOYSA-N
• XLogP: 15.91
• TPSA: 316.13 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 20
• Rotatable Bonds: 14
• Heavy Atoms: 102
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1440.31
LogP ≤ 5	15.91
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	20

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of methyl 7-amino-2-[2-fluoro-3-(2-methyl-1,3-oxazol-5-yl)phenyl]-1H-pyrrolo[2,3-c]pyridine-4-carboxylate;methyl 7-bromo-2-[2-fluoro-3-(2-methyl-1,3-oxazol-5-yl)phenyl]-1H-pyrrolo[2,3-c]pyridine-4-carboxylate;methyl 7-(dibenzylamino)-2-[2-fluoro-3-(2-methyl-1,3-oxazol-5-yl)phenyl]-1H-pyrrolo[2,3-c]pyridine-4-carboxylate;1-methylpyrazol-3-amine?

The IUPAC name of methyl 7-amino-2-[2-fluoro-3-(2-methyl-1,3-oxazol-5-yl)phenyl]-1H-pyrrolo[2,3-c]pyridine-4-carboxylate;methyl 7-bromo-2-[2-fluoro-3-(2-methyl-1,3-oxazol-5-yl)phenyl]-1H-pyrrolo[2,3-c]pyridine-4-carboxylate;methyl 7-(dibenzylamino)-2-[2-fluoro-3-(2-methyl-1,3-oxazol-5-yl)phenyl]-1H-pyrrolo[2,3-c]pyridine-4-carboxylate;1-methylpyrazol-3-amine (CID 164996330) is methyl 7-amino-2-[2-fluoro-3-(2-methyl-1,3-oxazol-5-yl)phenyl]-1H-pyrrolo[2,3-c]pyridine-4-carboxylate;methyl 7-bromo-2-[2-fluoro-3-(2-methyl-1,3-oxazol-5-yl)phenyl]-1H-pyrrolo[2,3-c]pyridine-4-carboxylate;methyl 7-(dibenzylamino)-2-[2-fluoro-3-(2-methyl-1,3-oxazol-5-yl)phenyl]-1H-pyrrolo[2,3-c]pyridine-4-carboxylate;1-methylpyrazol-3-amine.

What is the SMILES notation for methyl 7-amino-2-[2-fluoro-3-(2-methyl-1,3-oxazol-5-yl)phenyl]-1H-pyrrolo[2,3-c]pyridine-4-carboxylate;methyl 7-bromo-2-[2-fluoro-3-(2-methyl-1,3-oxazol-5-yl)phenyl]-1H-pyrrolo[2,3-c]pyridine-4-carboxylate;methyl 7-(dibenzylamino)-2-[2-fluoro-3-(2-methyl-1,3-oxazol-5-yl)phenyl]-1H-pyrrolo[2,3-c]pyridine-4-carboxylate;1-methylpyrazol-3-amine?

The canonical SMILES for methyl 7-amino-2-[2-fluoro-3-(2-methyl-1,3-oxazol-5-yl)phenyl]-1H-pyrrolo[2,3-c]pyridine-4-carboxylate;methyl 7-bromo-2-[2-fluoro-3-(2-methyl-1,3-oxazol-5-yl)phenyl]-1H-pyrrolo[2,3-c]pyridine-4-carboxylate;methyl 7-(dibenzylamino)-2-[2-fluoro-3-(2-methyl-1,3-oxazol-5-yl)phenyl]-1H-pyrrolo[2,3-c]pyridine-4-carboxylate;1-methylpyrazol-3-amine is COC(=O)c1cnc(Br)c2[nH]c(-c3cccc(-c4cnc(C)o4)c3F)cc12.COC(=O)c1cnc(N(Cc2ccccc2)Cc2ccccc2)c2[nH]c(-c3cccc(-c4cnc(C)o4)c3F)cc12.COC(=O)c1cnc(N)c2[nH]c(-c3cccc(-c4cnc(C)o4)c3F)cc12.Cn1ccc(N)n1.

What is the InChIKey of methyl 7-amino-2-[2-fluoro-3-(2-methyl-1,3-oxazol-5-yl)phenyl]-1H-pyrrolo[2,3-c]pyridine-4-carboxylate;methyl 7-bromo-2-[2-fluoro-3-(2-methyl-1,3-oxazol-5-yl)phenyl]-1H-pyrrolo[2,3-c]pyridine-4-carboxylate;methyl 7-(dibenzylamino)-2-[2-fluoro-3-(2-methyl-1,3-oxazol-5-yl)phenyl]-1H-pyrrolo[2,3-c]pyridine-4-carboxylate;1-methylpyrazol-3-amine?

The InChIKey is HPKYOMLEMPHYIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H27FN4O3.C19H13BrFN3O3.C19H15FN4O3.C4H7N3/c1-21-35-18-29(41-21)25-15-9-14-24(30(25)34)28-16-26-27(33(39)40-2)17-36-32(31(26)37-28)38(19-22-10-5-3-6-11-22)20-23-12-7-4-8-13-23;1-9-22-8-15(27-9)11-5-3-4-10(16(11)21)14-6-12-13(19(25)26-2)7-23-18(20)17(12)24-14;1-9-22-8-15(27-9)11-5-3-4-10(16(11)20)14-6-12-13(19(25)26-2)7-23-18(21)17(12)24-14;1-7-3-2-4(5)6-7/h3-18,37H,19-20H2,1-2H3;3-8,24H,1-2H3;3-8,24H,1-2H3,(H2,21,23);2-3H,1H3,(H2,5,6).

What are the key properties of methyl 7-amino-2-[2-fluoro-3-(2-methyl-1,3-oxazol-5-yl)phenyl]-1H-pyrrolo[2,3-c]pyridine-4-carboxylate;methyl 7-bromo-2-[2-fluoro-3-(2-methyl-1,3-oxazol-5-yl)phenyl]-1H-pyrrolo[2,3-c]pyridine-4-carboxylate;methyl 7-(dibenzylamino)-2-[2-fluoro-3-(2-methyl-1,3-oxazol-5-yl)phenyl]-1H-pyrrolo[2,3-c]pyridine-4-carboxylate;1-methylpyrazol-3-amine?

methyl 7-amino-2-[2-fluoro-3-(2-methyl-1,3-oxazol-5-yl)phenyl]-1H-pyrrolo[2,3-c]pyridine-4-carboxylate;methyl 7-bromo-2-[2-fluoro-3-(2-methyl-1,3-oxazol-5-yl)phenyl]-1H-pyrrolo[2,3-c]pyridine-4-carboxylate;methyl 7-(dibenzylamino)-2-[2-fluoro-3-(2-methyl-1,3-oxazol-5-yl)phenyl]-1H-pyrrolo[2,3-c]pyridine-4-carboxylate;1-methylpyrazol-3-amine has a molecular weight of 1440.31 g/mol, XLogP of 15.91, 14 rotatable bonds, 5 hydrogen bond donors, and 20 hydrogen bond acceptors.

Where does this data come from?

All data for methyl 7-amino-2-[2-fluoro-3-(2-methyl-1,3-oxazol-5-yl)phenyl]-1H-pyrrolo[2,3-c]pyridine-4-carboxylate;methyl 7-bromo-2-[2-fluoro-3-(2-methyl-1,3-oxazol-5-yl)phenyl]-1H-pyrrolo[2,3-c]pyridine-4-carboxylate;methyl 7-(dibenzylamino)-2-[2-fluoro-3-(2-methyl-1,3-oxazol-5-yl)phenyl]-1H-pyrrolo[2,3-c]pyridine-4-carboxylate;1-methylpyrazol-3-amine is sourced from PubChem (CID 164996330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).