N-[(2-methoxyphenyl)methyl]-3-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-(oxolan-2-ylmethyl)propanamide

C20H26N2O4S — CID 55967624

About N-[(2-methoxyphenyl)methyl]-3-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-(oxolan-2-ylmethyl)propanamide

N-[(2-methoxyphenyl)methyl]-3-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-(oxolan-2-ylmethyl)propanamide (PubChem CID 55967624) has the molecular formula C20H26N2O4S and a molecular weight of 390.51 g/mol. Its IUPAC name is N-[(2-methoxyphenyl)methyl]-3-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-(oxolan-2-ylmethyl)propanamide.

Molecular Properties

• Compound Name: N-[(2-methoxyphenyl)methyl]-3-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-(oxolan-2-ylmethyl)propanamide
• PubChem CID: 55967624
• Molecular Formula: C20H26N2O4S
• Molecular Weight: 390.51 g/mol
• Exact Mass: 390.16
• IUPAC Name: N-[(2-methoxyphenyl)methyl]-3-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-(oxolan-2-ylmethyl)propanamide
• SMILES: COc1ccccc1CN(CC1CCCO1)C(=O)CCn1c(C)csc1=O
• InChI: InChI=1S/C20H26N2O4S/c1-15-14-27-20(24)22(15)10-9-19(23)21(13-17-7-5-11-26-17)12-16-6-3-4-8-18(16)25-2/h3-4,6,8,14,17H,5,7,9-13H2,1-2H3
• InChIKey: ICDXLWLULFOJDL-UHFFFAOYSA-N
• XLogP: 2.82
• TPSA: 60.77 Ų
• H-Bond Acceptors: 6
• Rotatable Bonds: 8
• Heavy Atoms: 27
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	390.51
LogP ≤ 5	2.82
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of N-[(2-methoxyphenyl)methyl]-3-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-(oxolan-2-ylmethyl)propanamide?

The IUPAC name of N-[(2-methoxyphenyl)methyl]-3-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-(oxolan-2-ylmethyl)propanamide (CID 55967624) is N-[(2-methoxyphenyl)methyl]-3-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-(oxolan-2-ylmethyl)propanamide.

What is the SMILES notation for N-[(2-methoxyphenyl)methyl]-3-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-(oxolan-2-ylmethyl)propanamide?

The canonical SMILES for N-[(2-methoxyphenyl)methyl]-3-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-(oxolan-2-ylmethyl)propanamide is COc1ccccc1CN(CC1CCCO1)C(=O)CCn1c(C)csc1=O.

What is the InChIKey of N-[(2-methoxyphenyl)methyl]-3-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-(oxolan-2-ylmethyl)propanamide?

The InChIKey is ICDXLWLULFOJDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N2O4S/c1-15-14-27-20(24)22(15)10-9-19(23)21(13-17-7-5-11-26-17)12-16-6-3-4-8-18(16)25-2/h3-4,6,8,14,17H,5,7,9-13H2,1-2H3.

What are the key properties of N-[(2-methoxyphenyl)methyl]-3-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-(oxolan-2-ylmethyl)propanamide?

N-[(2-methoxyphenyl)methyl]-3-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-(oxolan-2-ylmethyl)propanamide has a molecular weight of 390.51 g/mol, XLogP of 2.82, 8 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for N-[(2-methoxyphenyl)methyl]-3-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-(oxolan-2-ylmethyl)propanamide is sourced from PubChem (CID 55967624), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).