2-methoxy-2-phenyl-N-[(4-pyridin-4-yl-1,3-thiazol-2-yl)methyl]acetamide

C18H17N3O2S — CID 56785329

IUPAC2-methoxy-2-phenyl-N-[(4-pyridin-4-yl-1,3-thiazol-2-yl)methyl]acetamide
SMILESCOC(C(=O)NCc1nc(-c2ccncc2)cs1)c1ccccc1
InChIInChI=1S/C18H17N3O2S/c1-23-17(14-5-3-2-4-6-14)18(22)20-11-16-21-15(12-24-16)13-7-9-19-10-8-13/h2-10,12,17H,11H2,1H3,(H,20,22)
InChIKeyZCYMJJGUKSVARX-UHFFFAOYSA-N
MW339.42 g/mol
LogP3.21
Rot. Bonds6

About 2-methoxy-2-phenyl-N-[(4-pyridin-4-yl-1,3-thiazol-2-yl)methyl]acetamide

2-methoxy-2-phenyl-N-[(4-pyridin-4-yl-1,3-thiazol-2-yl)methyl]acetamide (PubChem CID 56785329) has the molecular formula C18H17N3O2S and a molecular weight of 339.42 g/mol. Its IUPAC name is 2-methoxy-2-phenyl-N-[(4-pyridin-4-yl-1,3-thiazol-2-yl)methyl]acetamide.

Molecular Properties

Compound Name2-methoxy-2-phenyl-N-[(4-pyridin-4-yl-1,3-thiazol-2-yl)methyl]acetamide
PubChem CID56785329
Molecular FormulaC18H17N3O2S
Molecular Weight339.42 g/mol
Exact Mass339.10
IUPAC Name2-methoxy-2-phenyl-N-[(4-pyridin-4-yl-1,3-thiazol-2-yl)methyl]acetamide
SMILESCOC(C(=O)NCc1nc(-c2ccncc2)cs1)c1ccccc1
InChIInChI=1S/C18H17N3O2S/c1-23-17(14-5-3-2-4-6-14)18(22)20-11-16-21-15(12-24-16)13-7-9-19-10-8-13/h2-10,12,17H,11H2,1H3,(H,20,22)
InChIKeyZCYMJJGUKSVARX-UHFFFAOYSA-N
XLogP3.21
TPSA64.11 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.42
LogP ≤ 53.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-methoxy-2-phenyl-N-[(4-pyridin-4-yl-1,3-thiazol-2-yl)methyl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-methoxy-2-phenyl-N-[(3-pyridin-4-yl-1H-1,2,4-triazol-5-yl)methyl]acetamide
CID 16672586
benzyl N-[(2S,3S)-3-methyl-1-oxo-1-[(4-pyridin-4-yl-1,3-thiazol-2-yl)methylamino]pentan-2-yl]carbamate
CID 56585905
3-phenyl-N-[(4-pyridin-4-yl-1,3-thiazol-2-yl)methyl]propanamide
CID 110318189
(2S)-2-methoxy-N-[3-(4-methyl-1,3-thiazol-2-yl)propyl]-2-phenylacetamide
CID 125176822
3,5-dimethoxy-N-[(4-pyridin-4-yl-1,3-thiazol-2-yl)methyl]benzamide
CID 110318175
(E)-3-(2-methoxyphenyl)-2-phenyl-N-[(4-pyridin-4-yl-1,3-thiazol-2-yl)methyl]prop-2-enamide
CID 56586190
2-methoxy-N-[(6-methyl-2-pyridinyl)methyl]-2-phenylacetamide
CID 77097676
(2R)-2-amino-3-methyl-3-methylsulfanyl-N-[(4-phenyl-1,3-thiazol-2-yl)methyl]butanamide
CID 157018683
(2R)-2-(2-ethoxyethoxy)-N-[(4-phenyl-1,3-thiazol-2-yl)methyl]propanamide
CID 94796280
(2S)-2-(2-ethoxyethoxy)-N-[(4-phenyl-1,3-thiazol-2-yl)methyl]propanamide
CID 94796279
N-[(4-bromothiophen-2-yl)methyl]-2-methoxy-2-phenylacetamide
CID 60794285
2-methyl-3-(4-pyridin-4-yl-1,3-thiazol-2-yl)propanoic acid
CID 82118920

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-2-phenyl-N-[(4-pyridin-4-yl-1,3-thiazol-2-yl)methyl]acetamide?
The IUPAC name of 2-methoxy-2-phenyl-N-[(4-pyridin-4-yl-1,3-thiazol-2-yl)methyl]acetamide (CID 56785329) is 2-methoxy-2-phenyl-N-[(4-pyridin-4-yl-1,3-thiazol-2-yl)methyl]acetamide.
What is the SMILES notation for 2-methoxy-2-phenyl-N-[(4-pyridin-4-yl-1,3-thiazol-2-yl)methyl]acetamide?
The canonical SMILES for 2-methoxy-2-phenyl-N-[(4-pyridin-4-yl-1,3-thiazol-2-yl)methyl]acetamide is COC(C(=O)NCc1nc(-c2ccncc2)cs1)c1ccccc1.
What is the InChIKey of 2-methoxy-2-phenyl-N-[(4-pyridin-4-yl-1,3-thiazol-2-yl)methyl]acetamide?
The InChIKey is ZCYMJJGUKSVARX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N3O2S/c1-23-17(14-5-3-2-4-6-14)18(22)20-11-16-21-15(12-24-16)13-7-9-19-10-8-13/h2-10,12,17H,11H2,1H3,(H,20,22).
What are the key properties of 2-methoxy-2-phenyl-N-[(4-pyridin-4-yl-1,3-thiazol-2-yl)methyl]acetamide?
2-methoxy-2-phenyl-N-[(4-pyridin-4-yl-1,3-thiazol-2-yl)methyl]acetamide has a molecular weight of 339.42 g/mol, XLogP of 3.21, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-2-phenyl-N-[(4-pyridin-4-yl-1,3-thiazol-2-yl)methyl]acetamide is sourced from PubChem (CID 56785329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).