3-(3-methoxyphenyl)-N-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]-1H-pyrazole-5-carboxamide

C24H23N5O2 — CID 122282874

About 3-(3-methoxyphenyl)-N-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]-1H-pyrazole-5-carboxamide

3-(3-methoxyphenyl)-N-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]-1H-pyrazole-5-carboxamide (PubChem CID 122282874) has the molecular formula C24H23N5O2 and a molecular weight of 413.48 g/mol. Its IUPAC name is 3-(3-methoxyphenyl)-N-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]-1H-pyrazole-5-carboxamide.

Molecular Properties

• Compound Name: 3-(3-methoxyphenyl)-N-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]-1H-pyrazole-5-carboxamide
• PubChem CID: 122282874
• Molecular Formula: C24H23N5O2
• Molecular Weight: 413.48 g/mol
• Exact Mass: 413.19
• IUPAC Name: 3-(3-methoxyphenyl)-N-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]-1H-pyrazole-5-carboxamide
• SMILES: COc1cccc(-c2cc(C(=O)Nc3ccccc3-c3cn4c(n3)CCCC4)[nH]n2)c1
• InChI: InChI=1S/C24H23N5O2/c1-31-17-8-6-7-16(13-17)20-14-21(28-27-20)24(30)26-19-10-3-2-9-18(19)22-15-29-12-5-4-11-23(29)25-22/h2-3,6-10,13-15H,4-5,11-12H2,1H3,(H,26,30)(H,27,28)
• InChIKey: RMRJRRYXRCBRSE-UHFFFAOYSA-N
• XLogP: 4.54
• TPSA: 84.83 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 5
• Rotatable Bonds: 5
• Heavy Atoms: 31
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	413.48
LogP ≤ 5	4.54
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of 3-(3-methoxyphenyl)-N-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]-1H-pyrazole-5-carboxamide?

The IUPAC name of 3-(3-methoxyphenyl)-N-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]-1H-pyrazole-5-carboxamide (CID 122282874) is 3-(3-methoxyphenyl)-N-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]-1H-pyrazole-5-carboxamide.

What is the SMILES notation for 3-(3-methoxyphenyl)-N-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]-1H-pyrazole-5-carboxamide?

The canonical SMILES for 3-(3-methoxyphenyl)-N-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]-1H-pyrazole-5-carboxamide is COc1cccc(-c2cc(C(=O)Nc3ccccc3-c3cn4c(n3)CCCC4)[nH]n2)c1.

What is the InChIKey of 3-(3-methoxyphenyl)-N-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]-1H-pyrazole-5-carboxamide?

The InChIKey is RMRJRRYXRCBRSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23N5O2/c1-31-17-8-6-7-16(13-17)20-14-21(28-27-20)24(30)26-19-10-3-2-9-18(19)22-15-29-12-5-4-11-23(29)25-22/h2-3,6-10,13-15H,4-5,11-12H2,1H3,(H,26,30)(H,27,28).

What are the key properties of 3-(3-methoxyphenyl)-N-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]-1H-pyrazole-5-carboxamide?

3-(3-methoxyphenyl)-N-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]-1H-pyrazole-5-carboxamide has a molecular weight of 413.48 g/mol, XLogP of 4.54, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 3-(3-methoxyphenyl)-N-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]-1H-pyrazole-5-carboxamide is sourced from PubChem (CID 122282874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).