(6-chloro-2-methylimidazo[1,2-a]pyridin-3-yl)-[(3S)-3-[5-[(2-methoxyphenyl)methyl]-1,3-oxazol-2-yl]piperidin-1-yl]methanone

C25H25ClN4O3 — CID 124984218

About (6-chloro-2-methylimidazo[1,2-a]pyridin-3-yl)-[(3S)-3-[5-[(2-methoxyphenyl)methyl]-1,3-oxazol-2-yl]piperidin-1-yl]methanone

(6-chloro-2-methylimidazo[1,2-a]pyridin-3-yl)-[(3S)-3-[5-[(2-methoxyphenyl)methyl]-1,3-oxazol-2-yl]piperidin-1-yl]methanone (PubChem CID 124984218) has the molecular formula C25H25ClN4O3 and a molecular weight of 464.95 g/mol. Its IUPAC name is (6-chloro-2-methylimidazo[1,2-a]pyridin-3-yl)-[(3S)-3-[5-[(2-methoxyphenyl)methyl]-1,3-oxazol-2-yl]piperidin-1-yl]methanone.

Molecular Properties

• Compound Name: (6-chloro-2-methylimidazo[1,2-a]pyridin-3-yl)-[(3S)-3-[5-[(2-methoxyphenyl)methyl]-1,3-oxazol-2-yl]piperidin-1-yl]methanone
• PubChem CID: 124984218
• Molecular Formula: C25H25ClN4O3
• Molecular Weight: 464.95 g/mol
• Exact Mass: 464.16
• IUPAC Name: (6-chloro-2-methylimidazo[1,2-a]pyridin-3-yl)-[(3S)-3-[5-[(2-methoxyphenyl)methyl]-1,3-oxazol-2-yl]piperidin-1-yl]methanone
• SMILES: COc1ccccc1Cc1cnc([C@H]2CCCN(C(=O)c3c(C)nc4ccc(Cl)cn34)C2)o1
• InChI: InChI=1S/C25H25ClN4O3/c1-16-23(30-15-19(26)9-10-22(30)28-16)25(31)29-11-5-7-18(14-29)24-27-13-20(33-24)12-17-6-3-4-8-21(17)32-2/h3-4,6,8-10,13,15,18H,5,7,11-12,14H2,1-2H3/t18-/m0/s1
• InChIKey: NJFPWFHVIYGZAK-SFHVURJKSA-N
• XLogP: 4.90
• TPSA: 72.87 Ų
• H-Bond Acceptors: 6
• Rotatable Bonds: 5
• Heavy Atoms: 33
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	464.95
LogP ≤ 5	4.90
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of (6-chloro-2-methylimidazo[1,2-a]pyridin-3-yl)-[(3S)-3-[5-[(2-methoxyphenyl)methyl]-1,3-oxazol-2-yl]piperidin-1-yl]methanone?

The IUPAC name of (6-chloro-2-methylimidazo[1,2-a]pyridin-3-yl)-[(3S)-3-[5-[(2-methoxyphenyl)methyl]-1,3-oxazol-2-yl]piperidin-1-yl]methanone (CID 124984218) is (6-chloro-2-methylimidazo[1,2-a]pyridin-3-yl)-[(3S)-3-[5-[(2-methoxyphenyl)methyl]-1,3-oxazol-2-yl]piperidin-1-yl]methanone.

What is the SMILES notation for (6-chloro-2-methylimidazo[1,2-a]pyridin-3-yl)-[(3S)-3-[5-[(2-methoxyphenyl)methyl]-1,3-oxazol-2-yl]piperidin-1-yl]methanone?

The canonical SMILES for (6-chloro-2-methylimidazo[1,2-a]pyridin-3-yl)-[(3S)-3-[5-[(2-methoxyphenyl)methyl]-1,3-oxazol-2-yl]piperidin-1-yl]methanone is COc1ccccc1Cc1cnc([C@H]2CCCN(C(=O)c3c(C)nc4ccc(Cl)cn34)C2)o1.

What is the InChIKey of (6-chloro-2-methylimidazo[1,2-a]pyridin-3-yl)-[(3S)-3-[5-[(2-methoxyphenyl)methyl]-1,3-oxazol-2-yl]piperidin-1-yl]methanone?

The InChIKey is NJFPWFHVIYGZAK-SFHVURJKSA-N. The full InChI is InChI=1S/C25H25ClN4O3/c1-16-23(30-15-19(26)9-10-22(30)28-16)25(31)29-11-5-7-18(14-29)24-27-13-20(33-24)12-17-6-3-4-8-21(17)32-2/h3-4,6,8-10,13,15,18H,5,7,11-12,14H2,1-2H3/t18-/m0/s1.

What are the key properties of (6-chloro-2-methylimidazo[1,2-a]pyridin-3-yl)-[(3S)-3-[5-[(2-methoxyphenyl)methyl]-1,3-oxazol-2-yl]piperidin-1-yl]methanone?

(6-chloro-2-methylimidazo[1,2-a]pyridin-3-yl)-[(3S)-3-[5-[(2-methoxyphenyl)methyl]-1,3-oxazol-2-yl]piperidin-1-yl]methanone has a molecular weight of 464.95 g/mol, XLogP of 4.90, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for (6-chloro-2-methylimidazo[1,2-a]pyridin-3-yl)-[(3S)-3-[5-[(2-methoxyphenyl)methyl]-1,3-oxazol-2-yl]piperidin-1-yl]methanone is sourced from PubChem (CID 124984218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).