N-[2-(5-chloro-2-fluorophenyl)-4-pyridinyl]-1-[(4-methoxyphenyl)methyl]pyrazolo[4,3-b]pyridin-7-amine;N-[2-(5-chloro-2-fluorophenyl)-4-pyridinyl]-2-[(4-methoxyphenyl)methyl]pyrazolo[4,3-b]pyridin-7-amine

C50H38Cl2F2N10O2 — CID 160634898

About N-[2-(5-chloro-2-fluorophenyl)-4-pyridinyl]-1-[(4-methoxyphenyl)methyl]pyrazolo[4,3-b]pyridin-7-amine;N-[2-(5-chloro-2-fluorophenyl)-4-pyridinyl]-2-[(4-methoxyphenyl)methyl]pyrazolo[4,3-b]pyridin-7-amine

N-[2-(5-chloro-2-fluorophenyl)-4-pyridinyl]-1-[(4-methoxyphenyl)methyl]pyrazolo[4,3-b]pyridin-7-amine;N-[2-(5-chloro-2-fluorophenyl)-4-pyridinyl]-2-[(4-methoxyphenyl)methyl]pyrazolo[4,3-b]pyridin-7-amine (PubChem CID 160634898) has the molecular formula C50H38Cl2F2N10O2 and a molecular weight of 919.82 g/mol. Its IUPAC name is N-[2-(5-chloro-2-fluorophenyl)-4-pyridinyl]-1-[(4-methoxyphenyl)methyl]pyrazolo[4,3-b]pyridin-7-amine;N-[2-(5-chloro-2-fluorophenyl)-4-pyridinyl]-2-[(4-methoxyphenyl)methyl]pyrazolo[4,3-b]pyridin-7-amine.

Molecular Properties

• Compound Name: N-[2-(5-chloro-2-fluorophenyl)-4-pyridinyl]-1-[(4-methoxyphenyl)methyl]pyrazolo[4,3-b]pyridin-7-amine;N-[2-(5-chloro-2-fluorophenyl)-4-pyridinyl]-2-[(4-methoxyphenyl)methyl]pyrazolo[4,3-b]pyridin-7-amine
• PubChem CID: 160634898
• Molecular Formula: C50H38Cl2F2N10O2
• Molecular Weight: 919.82 g/mol
• Exact Mass: 918.25
• IUPAC Name: N-[2-(5-chloro-2-fluorophenyl)-4-pyridinyl]-1-[(4-methoxyphenyl)methyl]pyrazolo[4,3-b]pyridin-7-amine;N-[2-(5-chloro-2-fluorophenyl)-4-pyridinyl]-2-[(4-methoxyphenyl)methyl]pyrazolo[4,3-b]pyridin-7-amine
• SMILES: COc1ccc(Cn2cc3nccc(Nc4ccnc(-c5cc(Cl)ccc5F)c4)c3n2)cc1.COc1ccc(Cn2ncc3nccc(Nc4ccnc(-c5cc(Cl)ccc5F)c4)c32)cc1
• InChI: InChI=1S/2C25H19ClFN5O/c1-33-19-5-2-16(3-6-19)15-32-25-22(9-11-29-24(25)14-30-32)31-18-8-10-28-23(13-18)20-12-17(26)4-7-21(20)27;1-33-19-5-2-16(3-6-19)14-32-15-24-25(31-32)22(9-11-29-24)30-18-8-10-28-23(13-18)20-12-17(26)4-7-21(20)27/h2-14H,15H2,1H3,(H,28,29,31);2-13,15H,14H2,1H3,(H,28,30)
• InChIKey: RIKHSFLADHMLNP-UHFFFAOYSA-N
• XLogP: 12.17
• TPSA: 129.72 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 12
• Rotatable Bonds: 12
• Heavy Atoms: 66
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	919.82
LogP ≤ 5	12.17
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	12

Frequently Asked Questions

What is the IUPAC name of N-[2-(5-chloro-2-fluorophenyl)-4-pyridinyl]-1-[(4-methoxyphenyl)methyl]pyrazolo[4,3-b]pyridin-7-amine;N-[2-(5-chloro-2-fluorophenyl)-4-pyridinyl]-2-[(4-methoxyphenyl)methyl]pyrazolo[4,3-b]pyridin-7-amine?

The IUPAC name of N-[2-(5-chloro-2-fluorophenyl)-4-pyridinyl]-1-[(4-methoxyphenyl)methyl]pyrazolo[4,3-b]pyridin-7-amine;N-[2-(5-chloro-2-fluorophenyl)-4-pyridinyl]-2-[(4-methoxyphenyl)methyl]pyrazolo[4,3-b]pyridin-7-amine (CID 160634898) is N-[2-(5-chloro-2-fluorophenyl)-4-pyridinyl]-1-[(4-methoxyphenyl)methyl]pyrazolo[4,3-b]pyridin-7-amine;N-[2-(5-chloro-2-fluorophenyl)-4-pyridinyl]-2-[(4-methoxyphenyl)methyl]pyrazolo[4,3-b]pyridin-7-amine.

What is the SMILES notation for N-[2-(5-chloro-2-fluorophenyl)-4-pyridinyl]-1-[(4-methoxyphenyl)methyl]pyrazolo[4,3-b]pyridin-7-amine;N-[2-(5-chloro-2-fluorophenyl)-4-pyridinyl]-2-[(4-methoxyphenyl)methyl]pyrazolo[4,3-b]pyridin-7-amine?

The canonical SMILES for N-[2-(5-chloro-2-fluorophenyl)-4-pyridinyl]-1-[(4-methoxyphenyl)methyl]pyrazolo[4,3-b]pyridin-7-amine;N-[2-(5-chloro-2-fluorophenyl)-4-pyridinyl]-2-[(4-methoxyphenyl)methyl]pyrazolo[4,3-b]pyridin-7-amine is COc1ccc(Cn2cc3nccc(Nc4ccnc(-c5cc(Cl)ccc5F)c4)c3n2)cc1.COc1ccc(Cn2ncc3nccc(Nc4ccnc(-c5cc(Cl)ccc5F)c4)c32)cc1.

What is the InChIKey of N-[2-(5-chloro-2-fluorophenyl)-4-pyridinyl]-1-[(4-methoxyphenyl)methyl]pyrazolo[4,3-b]pyridin-7-amine;N-[2-(5-chloro-2-fluorophenyl)-4-pyridinyl]-2-[(4-methoxyphenyl)methyl]pyrazolo[4,3-b]pyridin-7-amine?

The InChIKey is RIKHSFLADHMLNP-UHFFFAOYSA-N. The full InChI is InChI=1S/2C25H19ClFN5O/c1-33-19-5-2-16(3-6-19)15-32-25-22(9-11-29-24(25)14-30-32)31-18-8-10-28-23(13-18)20-12-17(26)4-7-21(20)27;1-33-19-5-2-16(3-6-19)14-32-15-24-25(31-32)22(9-11-29-24)30-18-8-10-28-23(13-18)20-12-17(26)4-7-21(20)27/h2-14H,15H2,1H3,(H,28,29,31);2-13,15H,14H2,1H3,(H,28,30).

What are the key properties of N-[2-(5-chloro-2-fluorophenyl)-4-pyridinyl]-1-[(4-methoxyphenyl)methyl]pyrazolo[4,3-b]pyridin-7-amine;N-[2-(5-chloro-2-fluorophenyl)-4-pyridinyl]-2-[(4-methoxyphenyl)methyl]pyrazolo[4,3-b]pyridin-7-amine?

N-[2-(5-chloro-2-fluorophenyl)-4-pyridinyl]-1-[(4-methoxyphenyl)methyl]pyrazolo[4,3-b]pyridin-7-amine;N-[2-(5-chloro-2-fluorophenyl)-4-pyridinyl]-2-[(4-methoxyphenyl)methyl]pyrazolo[4,3-b]pyridin-7-amine has a molecular weight of 919.82 g/mol, XLogP of 12.17, 12 rotatable bonds, 2 hydrogen bond donors, and 12 hydrogen bond acceptors.

Where does this data come from?

All data for N-[2-(5-chloro-2-fluorophenyl)-4-pyridinyl]-1-[(4-methoxyphenyl)methyl]pyrazolo[4,3-b]pyridin-7-amine;N-[2-(5-chloro-2-fluorophenyl)-4-pyridinyl]-2-[(4-methoxyphenyl)methyl]pyrazolo[4,3-b]pyridin-7-amine is sourced from PubChem (CID 160634898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).