8-amino-5-(8-chloro-3-methylimidazo[1,2-a]pyridin-6-yl)-6-(4-fluorophenyl)-N-propan-2-ylimidazo[1,2-a]pyrazine-2-carboxamide

C₂₄H₂₁ClFN₇O — CID 150031519

About 8-amino-5-(8-chloro-3-methylimidazo[1,2-a]pyridin-6-yl)-6-(4-fluorophenyl)-N-propan-2-ylimidazo[1,2-a]pyrazine-2-carboxamide

8-amino-5-(8-chloro-3-methylimidazo[1,2-a]pyridin-6-yl)-6-(4-fluorophenyl)-N-propan-2-ylimidazo[1,2-a]pyrazine-2-carboxamide (PubChem CID 150031519) has the molecular formula C₂₄H₂₁ClFN₇O and a molecular weight of 477.93 g/mol. Its IUPAC name is 8-amino-5-(8-chloro-3-methylimidazo[1,2-a]pyridin-6-yl)-6-(4-fluorophenyl)-N-propan-2-ylimidazo[1,2-a]pyrazine-2-carboxamide.

Molecular Properties

• Compound Name: 8-amino-5-(8-chloro-3-methylimidazo[1,2-a]pyridin-6-yl)-6-(4-fluorophenyl)-N-propan-2-ylimidazo[1,2-a]pyrazine-2-carboxamide
• PubChem CID: 150031519
• Molecular Formula: C₂₄H₂₁ClFN₇O
• Molecular Weight: 477.93 g/mol
• Exact Mass: 477.15
• IUPAC Name: 8-amino-5-(8-chloro-3-methylimidazo[1,2-a]pyridin-6-yl)-6-(4-fluorophenyl)-N-propan-2-ylimidazo[1,2-a]pyrazine-2-carboxamide
• SMILES: Cc1cnc2c(Cl)cc(-c3c(-c4ccc(F)cc4)nc(N)c4nc(C(=O)NC(C)C)cn34)cn12
• InChI: InChI=1S/C24H21ClFN7O/c1-12(2)29-24(34)18-11-33-20(15-8-17(25)22-28-9-13(3)32(22)10-15)19(31-21(27)23(33)30-18)14-4-6-16(26)7-5-14/h4-12H,1-3H3,(H2,27,31)(H,29,34)
• InChIKey: DHJCULXELBLDPE-UHFFFAOYSA-N
• XLogP: 4.53
• TPSA: 102.61 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 7
• Rotatable Bonds: 4
• Heavy Atoms: 34
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	477.93
LogP ≤ 5	4.53
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	7

Frequently Asked Questions

What is the IUPAC name of 8-amino-5-(8-chloro-3-methylimidazo[1,2-a]pyridin-6-yl)-6-(4-fluorophenyl)-N-propan-2-ylimidazo[1,2-a]pyrazine-2-carboxamide?

The IUPAC name of 8-amino-5-(8-chloro-3-methylimidazo[1,2-a]pyridin-6-yl)-6-(4-fluorophenyl)-N-propan-2-ylimidazo[1,2-a]pyrazine-2-carboxamide (CID 150031519) is 8-amino-5-(8-chloro-3-methylimidazo[1,2-a]pyridin-6-yl)-6-(4-fluorophenyl)-N-propan-2-ylimidazo[1,2-a]pyrazine-2-carboxamide.

What is the SMILES notation for 8-amino-5-(8-chloro-3-methylimidazo[1,2-a]pyridin-6-yl)-6-(4-fluorophenyl)-N-propan-2-ylimidazo[1,2-a]pyrazine-2-carboxamide?

The canonical SMILES for 8-amino-5-(8-chloro-3-methylimidazo[1,2-a]pyridin-6-yl)-6-(4-fluorophenyl)-N-propan-2-ylimidazo[1,2-a]pyrazine-2-carboxamide is Cc1cnc2c(Cl)cc(-c3c(-c4ccc(F)cc4)nc(N)c4nc(C(=O)NC(C)C)cn34)cn12.

What is the InChIKey of 8-amino-5-(8-chloro-3-methylimidazo[1,2-a]pyridin-6-yl)-6-(4-fluorophenyl)-N-propan-2-ylimidazo[1,2-a]pyrazine-2-carboxamide?

The InChIKey is DHJCULXELBLDPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H21ClFN7O/c1-12(2)29-24(34)18-11-33-20(15-8-17(25)22-28-9-13(3)32(22)10-15)19(31-21(27)23(33)30-18)14-4-6-16(26)7-5-14/h4-12H,1-3H3,(H2,27,31)(H,29,34).

What are the key properties of 8-amino-5-(8-chloro-3-methylimidazo[1,2-a]pyridin-6-yl)-6-(4-fluorophenyl)-N-propan-2-ylimidazo[1,2-a]pyrazine-2-carboxamide?

8-amino-5-(8-chloro-3-methylimidazo[1,2-a]pyridin-6-yl)-6-(4-fluorophenyl)-N-propan-2-ylimidazo[1,2-a]pyrazine-2-carboxamide has a molecular weight of 477.93 g/mol, XLogP of 4.53, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for 8-amino-5-(8-chloro-3-methylimidazo[1,2-a]pyridin-6-yl)-6-(4-fluorophenyl)-N-propan-2-ylimidazo[1,2-a]pyrazine-2-carboxamide is sourced from PubChem (CID 150031519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 150031519 — identifiers, structure, computed properties (public domain)

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