2-methoxy-N-[5-[(2-methylphenyl)methyl]-1,3-thiazol-2-yl]-2-phenylacetamide

C20H20N2O2S — CID 143018395

IUPAC2-methoxy-N-[5-[(2-methylphenyl)methyl]-1,3-thiazol-2-yl]-2-phenylacetamide
SMILESCOC(C(=O)Nc1ncc(Cc2ccccc2C)s1)c1ccccc1
InChIInChI=1S/C20H20N2O2S/c1-14-8-6-7-11-16(14)12-17-13-21-20(25-17)22-19(23)18(24-2)15-9-4-3-5-10-15/h3-11,13,18H,12H2,1-2H3,(H,21,22,23)
InChIKeyBYWBDTQQUCCUOC-UHFFFAOYSA-N
MW352.46 g/mol
LogP4.37
Rot. Bonds6

About 2-methoxy-N-[5-[(2-methylphenyl)methyl]-1,3-thiazol-2-yl]-2-phenylacetamide

2-methoxy-N-[5-[(2-methylphenyl)methyl]-1,3-thiazol-2-yl]-2-phenylacetamide (PubChem CID 143018395) has the molecular formula C20H20N2O2S and a molecular weight of 352.46 g/mol. Its IUPAC name is 2-methoxy-N-[5-[(2-methylphenyl)methyl]-1,3-thiazol-2-yl]-2-phenylacetamide.

Molecular Properties

Compound Name2-methoxy-N-[5-[(2-methylphenyl)methyl]-1,3-thiazol-2-yl]-2-phenylacetamide
PubChem CID143018395
Molecular FormulaC20H20N2O2S
Molecular Weight352.46 g/mol
Exact Mass352.12
IUPAC Name2-methoxy-N-[5-[(2-methylphenyl)methyl]-1,3-thiazol-2-yl]-2-phenylacetamide
SMILESCOC(C(=O)Nc1ncc(Cc2ccccc2C)s1)c1ccccc1
InChIInChI=1S/C20H20N2O2S/c1-14-8-6-7-11-16(14)12-17-13-21-20(25-17)22-19(23)18(24-2)15-9-4-3-5-10-15/h3-11,13,18H,12H2,1-2H3,(H,21,22,23)
InChIKeyBYWBDTQQUCCUOC-UHFFFAOYSA-N
XLogP4.37
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.46
LogP ≤ 54.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[5-[(2-methoxyphenyl)methyl]-1,3-thiazol-2-yl]-3-methyl-2-phenylpentanamide
CID 58033028
N-[5-[(2-methylphenyl)methyl]-1,3-thiazol-2-yl]oxane-4-carboxamide
CID 51081209
2-N-[5-[(2-methylphenyl)methyl]-1,3-thiazol-2-yl]pyridine-2,5-dicarboxamide
CID 51130187
N-(5-benzyl-1,3-thiazol-2-yl)-2-phenylbutanamide
CID 58033083
(2R)-2-methoxy-N-[5-[4-[5-[(2-methoxy-2-phenylacetyl)amino]-1,3,4-thiadiazol-2-yl]butyl]-1,3,4-thiadiazol-2-yl]-2-phenylacetamide
CID 134302619
N-[5-[(2,3-dichlorophenyl)methyl]-1,3-thiazol-2-yl]-2-methylpropanamide
CID 727735
2-chloro-N-[5-[(2-chlorophenyl)methyl]-1,3-thiazol-2-yl]propanamide
CID 4969221
2-amino-N-[5-[(2-chlorophenyl)methyl]-1,3-thiazol-2-yl]-3-methoxypropanamide
CID 120984436
N-[5-[(2-fluorophenyl)methyl]-1,3-thiazol-2-yl]acetamide
CID 2227870
2-chloro-N-[5-[(3-methylphenyl)methyl]-1,3-thiazol-2-yl]-2-phenylacetamide
CID 4969220
3-methyl-N-[5-[(2-methylphenyl)methyl]-1,3-thiazol-2-yl]-1-oxo-4H-isochromene-3-carboxamide
CID 3159005
N-(5-benzyl-1,3-thiazol-2-yl)-2-phenoxypropanamide
CID 2988067

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-[5-[(2-methylphenyl)methyl]-1,3-thiazol-2-yl]-2-phenylacetamide?
The IUPAC name of 2-methoxy-N-[5-[(2-methylphenyl)methyl]-1,3-thiazol-2-yl]-2-phenylacetamide (CID 143018395) is 2-methoxy-N-[5-[(2-methylphenyl)methyl]-1,3-thiazol-2-yl]-2-phenylacetamide.
What is the SMILES notation for 2-methoxy-N-[5-[(2-methylphenyl)methyl]-1,3-thiazol-2-yl]-2-phenylacetamide?
The canonical SMILES for 2-methoxy-N-[5-[(2-methylphenyl)methyl]-1,3-thiazol-2-yl]-2-phenylacetamide is COC(C(=O)Nc1ncc(Cc2ccccc2C)s1)c1ccccc1.
What is the InChIKey of 2-methoxy-N-[5-[(2-methylphenyl)methyl]-1,3-thiazol-2-yl]-2-phenylacetamide?
The InChIKey is BYWBDTQQUCCUOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N2O2S/c1-14-8-6-7-11-16(14)12-17-13-21-20(25-17)22-19(23)18(24-2)15-9-4-3-5-10-15/h3-11,13,18H,12H2,1-2H3,(H,21,22,23).
What are the key properties of 2-methoxy-N-[5-[(2-methylphenyl)methyl]-1,3-thiazol-2-yl]-2-phenylacetamide?
2-methoxy-N-[5-[(2-methylphenyl)methyl]-1,3-thiazol-2-yl]-2-phenylacetamide has a molecular weight of 352.46 g/mol, XLogP of 4.37, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-[5-[(2-methylphenyl)methyl]-1,3-thiazol-2-yl]-2-phenylacetamide is sourced from PubChem (CID 143018395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).