N-[3-(1-ethylpyrazol-4-yl)-6-methylimidazo[1,2-a]pyrazin-8-yl]-3-[(3-methylpiperidin-1-yl)methyl]-1,2-thiazol-5-amine;N-(3-fluoro-4-pyridinyl)formamide

C28H33FN10OS — CID 143755906

About N-[3-(1-ethylpyrazol-4-yl)-6-methylimidazo[1,2-a]pyrazin-8-yl]-3-[(3-methylpiperidin-1-yl)methyl]-1,2-thiazol-5-amine;N-(3-fluoro-4-pyridinyl)formamide

N-[3-(1-ethylpyrazol-4-yl)-6-methylimidazo[1,2-a]pyrazin-8-yl]-3-[(3-methylpiperidin-1-yl)methyl]-1,2-thiazol-5-amine;N-(3-fluoro-4-pyridinyl)formamide (PubChem CID 143755906) has the molecular formula C28H33FN10OS and a molecular weight of 576.71 g/mol. Its IUPAC name is N-[3-(1-ethylpyrazol-4-yl)-6-methylimidazo[1,2-a]pyrazin-8-yl]-3-[(3-methylpiperidin-1-yl)methyl]-1,2-thiazol-5-amine;N-(3-fluoro-4-pyridinyl)formamide.

Molecular Properties

• Compound Name: N-[3-(1-ethylpyrazol-4-yl)-6-methylimidazo[1,2-a]pyrazin-8-yl]-3-[(3-methylpiperidin-1-yl)methyl]-1,2-thiazol-5-amine;N-(3-fluoro-4-pyridinyl)formamide
• PubChem CID: 143755906
• Molecular Formula: C28H33FN10OS
• Molecular Weight: 576.71 g/mol
• Exact Mass: 576.25
• IUPAC Name: N-[3-(1-ethylpyrazol-4-yl)-6-methylimidazo[1,2-a]pyrazin-8-yl]-3-[(3-methylpiperidin-1-yl)methyl]-1,2-thiazol-5-amine;N-(3-fluoro-4-pyridinyl)formamide
• SMILES: CCn1cc(-c2cnc3c(Nc4cc(CN5CCCC(C)C5)ns4)nc(C)cn23)cn1.O=CNc1ccncc1F
• InChI: InChI=1S/C22H28N8S.C6H5FN2O/c1-4-29-13-17(9-24-29)19-10-23-22-21(25-16(3)12-30(19)22)26-20-8-18(27-31-20)14-28-7-5-6-15(2)11-28;7-5-3-8-2-1-6(5)9-4-10/h8-10,12-13,15H,4-7,11,14H2,1-3H3,(H,25,26);1-4H,(H,8,9,10)
• InChIKey: FZTWLTOJXHWOJA-UHFFFAOYSA-N
• XLogP: 5.14
• TPSA: 118.16 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 11
• Rotatable Bonds: 8
• Heavy Atoms: 41
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	576.71
LogP ≤ 5	5.14
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	11

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'aldehyde', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of N-[3-(1-ethylpyrazol-4-yl)-6-methylimidazo[1,2-a]pyrazin-8-yl]-3-[(3-methylpiperidin-1-yl)methyl]-1,2-thiazol-5-amine;N-(3-fluoro-4-pyridinyl)formamide?

The IUPAC name of N-[3-(1-ethylpyrazol-4-yl)-6-methylimidazo[1,2-a]pyrazin-8-yl]-3-[(3-methylpiperidin-1-yl)methyl]-1,2-thiazol-5-amine;N-(3-fluoro-4-pyridinyl)formamide (CID 143755906) is N-[3-(1-ethylpyrazol-4-yl)-6-methylimidazo[1,2-a]pyrazin-8-yl]-3-[(3-methylpiperidin-1-yl)methyl]-1,2-thiazol-5-amine;N-(3-fluoro-4-pyridinyl)formamide.

What is the SMILES notation for N-[3-(1-ethylpyrazol-4-yl)-6-methylimidazo[1,2-a]pyrazin-8-yl]-3-[(3-methylpiperidin-1-yl)methyl]-1,2-thiazol-5-amine;N-(3-fluoro-4-pyridinyl)formamide?

The canonical SMILES for N-[3-(1-ethylpyrazol-4-yl)-6-methylimidazo[1,2-a]pyrazin-8-yl]-3-[(3-methylpiperidin-1-yl)methyl]-1,2-thiazol-5-amine;N-(3-fluoro-4-pyridinyl)formamide is CCn1cc(-c2cnc3c(Nc4cc(CN5CCCC(C)C5)ns4)nc(C)cn23)cn1.O=CNc1ccncc1F.

What is the InChIKey of N-[3-(1-ethylpyrazol-4-yl)-6-methylimidazo[1,2-a]pyrazin-8-yl]-3-[(3-methylpiperidin-1-yl)methyl]-1,2-thiazol-5-amine;N-(3-fluoro-4-pyridinyl)formamide?

The InChIKey is FZTWLTOJXHWOJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H28N8S.C6H5FN2O/c1-4-29-13-17(9-24-29)19-10-23-22-21(25-16(3)12-30(19)22)26-20-8-18(27-31-20)14-28-7-5-6-15(2)11-28;7-5-3-8-2-1-6(5)9-4-10/h8-10,12-13,15H,4-7,11,14H2,1-3H3,(H,25,26);1-4H,(H,8,9,10).

What are the key properties of N-[3-(1-ethylpyrazol-4-yl)-6-methylimidazo[1,2-a]pyrazin-8-yl]-3-[(3-methylpiperidin-1-yl)methyl]-1,2-thiazol-5-amine;N-(3-fluoro-4-pyridinyl)formamide?

N-[3-(1-ethylpyrazol-4-yl)-6-methylimidazo[1,2-a]pyrazin-8-yl]-3-[(3-methylpiperidin-1-yl)methyl]-1,2-thiazol-5-amine;N-(3-fluoro-4-pyridinyl)formamide has a molecular weight of 576.71 g/mol, XLogP of 5.14, 8 rotatable bonds, 2 hydrogen bond donors, and 11 hydrogen bond acceptors.

Where does this data come from?

All data for N-[3-(1-ethylpyrazol-4-yl)-6-methylimidazo[1,2-a]pyrazin-8-yl]-3-[(3-methylpiperidin-1-yl)methyl]-1,2-thiazol-5-amine;N-(3-fluoro-4-pyridinyl)formamide is sourced from PubChem (CID 143755906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).