N-(4-cyanophenyl)-N-methyl-3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyrazine-6-carboxamide

C24H21N5O2 — CID 90157374

About N-(4-cyanophenyl)-N-methyl-3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyrazine-6-carboxamide

N-(4-cyanophenyl)-N-methyl-3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyrazine-6-carboxamide (PubChem CID 90157374) has the molecular formula C24H21N5O2 and a molecular weight of 411.47 g/mol. Its IUPAC name is N-(4-cyanophenyl)-N-methyl-3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyrazine-6-carboxamide.

Molecular Properties

• Compound Name: N-(4-cyanophenyl)-N-methyl-3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyrazine-6-carboxamide
• PubChem CID: 90157374
• Molecular Formula: C24H21N5O2
• Molecular Weight: 411.47 g/mol
• Exact Mass: 411.17
• IUPAC Name: N-(4-cyanophenyl)-N-methyl-3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyrazine-6-carboxamide
• SMILES: CC(C)Oc1ccc(-c2cnc3cnc(C(=O)N(C)c4ccc(C#N)cc4)cn23)cc1
• InChI: InChI=1S/C24H21N5O2/c1-16(2)31-20-10-6-18(7-11-20)22-13-27-23-14-26-21(15-29(22)23)24(30)28(3)19-8-4-17(12-25)5-9-19/h4-11,13-16H,1-3H3
• InChIKey: CYHUJZWWUWVPBJ-UHFFFAOYSA-N
• XLogP: 4.33
• TPSA: 83.52 Ų
• H-Bond Acceptors: 6
• Rotatable Bonds: 5
• Heavy Atoms: 31
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	411.47
LogP ≤ 5	4.33
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of N-(4-cyanophenyl)-N-methyl-3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyrazine-6-carboxamide?

The IUPAC name of N-(4-cyanophenyl)-N-methyl-3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyrazine-6-carboxamide (CID 90157374) is N-(4-cyanophenyl)-N-methyl-3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyrazine-6-carboxamide.

What is the SMILES notation for N-(4-cyanophenyl)-N-methyl-3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyrazine-6-carboxamide?

The canonical SMILES for N-(4-cyanophenyl)-N-methyl-3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyrazine-6-carboxamide is CC(C)Oc1ccc(-c2cnc3cnc(C(=O)N(C)c4ccc(C#N)cc4)cn23)cc1.

What is the InChIKey of N-(4-cyanophenyl)-N-methyl-3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyrazine-6-carboxamide?

The InChIKey is CYHUJZWWUWVPBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H21N5O2/c1-16(2)31-20-10-6-18(7-11-20)22-13-27-23-14-26-21(15-29(22)23)24(30)28(3)19-8-4-17(12-25)5-9-19/h4-11,13-16H,1-3H3.

What are the key properties of N-(4-cyanophenyl)-N-methyl-3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyrazine-6-carboxamide?

N-(4-cyanophenyl)-N-methyl-3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyrazine-6-carboxamide has a molecular weight of 411.47 g/mol, XLogP of 4.33, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for N-(4-cyanophenyl)-N-methyl-3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyrazine-6-carboxamide is sourced from PubChem (CID 90157374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).