N-[6-[6-amino-5-(trifluoromethyl)-3-pyridinyl]imidazo[1,2-a]pyridin-2-yl]-4-fluorobenzamide

C20H13F4N5O — CID 59252002

About N-[6-[6-amino-5-(trifluoromethyl)-3-pyridinyl]imidazo[1,2-a]pyridin-2-yl]-4-fluorobenzamide

N-[6-[6-amino-5-(trifluoromethyl)-3-pyridinyl]imidazo[1,2-a]pyridin-2-yl]-4-fluorobenzamide (PubChem CID 59252002) has the molecular formula C20H13F4N5O and a molecular weight of 415.35 g/mol. Its IUPAC name is N-[6-[6-amino-5-(trifluoromethyl)-3-pyridinyl]imidazo[1,2-a]pyridin-2-yl]-4-fluorobenzamide.

Molecular Properties

• Compound Name: N-[6-[6-amino-5-(trifluoromethyl)-3-pyridinyl]imidazo[1,2-a]pyridin-2-yl]-4-fluorobenzamide
• PubChem CID: 59252002
• Molecular Formula: C20H13F4N5O
• Molecular Weight: 415.35 g/mol
• Exact Mass: 415.11
• IUPAC Name: N-[6-[6-amino-5-(trifluoromethyl)-3-pyridinyl]imidazo[1,2-a]pyridin-2-yl]-4-fluorobenzamide
• SMILES: Nc1ncc(-c2ccc3nc(NC(=O)c4ccc(F)cc4)cn3c2)cc1C(F)(F)F
• InChI: InChI=1S/C20H13F4N5O/c21-14-4-1-11(2-5-14)19(30)28-16-10-29-9-12(3-6-17(29)27-16)13-7-15(20(22,23)24)18(25)26-8-13/h1-10H,(H2,25,26)(H,28,30)
• InChIKey: XBVLWNHSQMEMKE-UHFFFAOYSA-N
• XLogP: 4.39
• TPSA: 85.31 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 5
• Rotatable Bonds: 3
• Heavy Atoms: 30
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	415.35
LogP ≤ 5	4.39
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of N-[6-[6-amino-5-(trifluoromethyl)-3-pyridinyl]imidazo[1,2-a]pyridin-2-yl]-4-fluorobenzamide?

The IUPAC name of N-[6-[6-amino-5-(trifluoromethyl)-3-pyridinyl]imidazo[1,2-a]pyridin-2-yl]-4-fluorobenzamide (CID 59252002) is N-[6-[6-amino-5-(trifluoromethyl)-3-pyridinyl]imidazo[1,2-a]pyridin-2-yl]-4-fluorobenzamide.

What is the SMILES notation for N-[6-[6-amino-5-(trifluoromethyl)-3-pyridinyl]imidazo[1,2-a]pyridin-2-yl]-4-fluorobenzamide?

The canonical SMILES for N-[6-[6-amino-5-(trifluoromethyl)-3-pyridinyl]imidazo[1,2-a]pyridin-2-yl]-4-fluorobenzamide is Nc1ncc(-c2ccc3nc(NC(=O)c4ccc(F)cc4)cn3c2)cc1C(F)(F)F.

What is the InChIKey of N-[6-[6-amino-5-(trifluoromethyl)-3-pyridinyl]imidazo[1,2-a]pyridin-2-yl]-4-fluorobenzamide?

The InChIKey is XBVLWNHSQMEMKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H13F4N5O/c21-14-4-1-11(2-5-14)19(30)28-16-10-29-9-12(3-6-17(29)27-16)13-7-15(20(22,23)24)18(25)26-8-13/h1-10H,(H2,25,26)(H,28,30).

What are the key properties of N-[6-[6-amino-5-(trifluoromethyl)-3-pyridinyl]imidazo[1,2-a]pyridin-2-yl]-4-fluorobenzamide?

N-[6-[6-amino-5-(trifluoromethyl)-3-pyridinyl]imidazo[1,2-a]pyridin-2-yl]-4-fluorobenzamide has a molecular weight of 415.35 g/mol, XLogP of 4.39, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for N-[6-[6-amino-5-(trifluoromethyl)-3-pyridinyl]imidazo[1,2-a]pyridin-2-yl]-4-fluorobenzamide is sourced from PubChem (CID 59252002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).