N-[1-[4-(6-methoxy-3-pyridinyl)-1,3-thiazol-2-yl]-1-phenylethyl]acetamide

C19H19N3O2S — CID 46947978

IUPACN-[1-[4-(6-methoxy-3-pyridinyl)-1,3-thiazol-2-yl]-1-phenylethyl]acetamide
SMILESCOc1ccc(-c2csc(C(C)(NC(C)=O)c3ccccc3)n2)cn1
InChIInChI=1S/C19H19N3O2S/c1-13(23)22-19(2,15-7-5-4-6-8-15)18-21-16(12-25-18)14-9-10-17(24-3)20-11-14/h4-12H,1-3H3,(H,22,23)
InChIKeyMATRJGJJODUCDC-UHFFFAOYSA-N
MW353.45 g/mol
LogP3.61
Rot. Bonds5

About N-[1-[4-(6-methoxy-3-pyridinyl)-1,3-thiazol-2-yl]-1-phenylethyl]acetamide

N-[1-[4-(6-methoxy-3-pyridinyl)-1,3-thiazol-2-yl]-1-phenylethyl]acetamide (PubChem CID 46947978) has the molecular formula C19H19N3O2S and a molecular weight of 353.45 g/mol. Its IUPAC name is N-[1-[4-(6-methoxy-3-pyridinyl)-1,3-thiazol-2-yl]-1-phenylethyl]acetamide.

Molecular Properties

Compound NameN-[1-[4-(6-methoxy-3-pyridinyl)-1,3-thiazol-2-yl]-1-phenylethyl]acetamide
PubChem CID46947978
Molecular FormulaC19H19N3O2S
Molecular Weight353.45 g/mol
Exact Mass353.12
IUPAC NameN-[1-[4-(6-methoxy-3-pyridinyl)-1,3-thiazol-2-yl]-1-phenylethyl]acetamide
SMILESCOc1ccc(-c2csc(C(C)(NC(C)=O)c3ccccc3)n2)cn1
InChIInChI=1S/C19H19N3O2S/c1-13(23)22-19(2,15-7-5-4-6-8-15)18-21-16(12-25-18)14-9-10-17(24-3)20-11-14/h4-12H,1-3H3,(H,22,23)
InChIKeyMATRJGJJODUCDC-UHFFFAOYSA-N
XLogP3.61
TPSA64.11 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.45
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-(6-methoxy-3-pyridinyl)-2,4-dimethylpyridine-3-carboxylic acid
CID 163318387
N-[3-[2-[1-hydroxy-1-(3-methoxyphenyl)ethyl]-1,3-thiazol-4-yl]phenyl]acetamide
CID 46948001
5-tert-butyl-2-(6-methoxy-3-pyridinyl)pyridine
CID 89491323
(2R)-2-cyano-N-(6-methoxy-3-pyridinyl)-2-phenylpropanamide
CID 100784971
5-(4-tert-butylphenyl)-2-methoxypyridine
CID 67097821
2-(6-methoxy-3-pyridinyl)-5-methyl-1,3-thiazole-4-carboxylic acid
CID 114937601
(6-methoxy-3-pyridinyl)-diphenylmethanol
CID 141319613
(3R)-3-benzyl-4-[[4-[2-(6-methoxy-3-pyridinyl)phenyl]-1,3-thiazol-2-yl]methylamino]-4-oxobutanoic acid
CID 67402179
5-(6-methoxy-3-pyridinyl)benzo[g][1]benzofuran-2-carboxylic acid
CID 142713735
6-methoxy-N-(4-phenyl-1,3-thiazol-2-yl)-N-prop-2-enylpyridine-3-carboxamide
CID 134016011
acetylene;2-methoxy-5-[1-[(2E,4Z)-2-methyl-1,1-diphenylhexa-2,4-dienyl]imidazol-4-yl]pyridine
CID 142961849
methyl 2-(6-methoxy-3-pyridinyl)-2-methylpropanoate
CID 150017667

Frequently Asked Questions

What is the IUPAC name of N-[1-[4-(6-methoxy-3-pyridinyl)-1,3-thiazol-2-yl]-1-phenylethyl]acetamide?
The IUPAC name of N-[1-[4-(6-methoxy-3-pyridinyl)-1,3-thiazol-2-yl]-1-phenylethyl]acetamide (CID 46947978) is N-[1-[4-(6-methoxy-3-pyridinyl)-1,3-thiazol-2-yl]-1-phenylethyl]acetamide.
What is the SMILES notation for N-[1-[4-(6-methoxy-3-pyridinyl)-1,3-thiazol-2-yl]-1-phenylethyl]acetamide?
The canonical SMILES for N-[1-[4-(6-methoxy-3-pyridinyl)-1,3-thiazol-2-yl]-1-phenylethyl]acetamide is COc1ccc(-c2csc(C(C)(NC(C)=O)c3ccccc3)n2)cn1.
What is the InChIKey of N-[1-[4-(6-methoxy-3-pyridinyl)-1,3-thiazol-2-yl]-1-phenylethyl]acetamide?
The InChIKey is MATRJGJJODUCDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O2S/c1-13(23)22-19(2,15-7-5-4-6-8-15)18-21-16(12-25-18)14-9-10-17(24-3)20-11-14/h4-12H,1-3H3,(H,22,23).
What are the key properties of N-[1-[4-(6-methoxy-3-pyridinyl)-1,3-thiazol-2-yl]-1-phenylethyl]acetamide?
N-[1-[4-(6-methoxy-3-pyridinyl)-1,3-thiazol-2-yl]-1-phenylethyl]acetamide has a molecular weight of 353.45 g/mol, XLogP of 3.61, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[4-(6-methoxy-3-pyridinyl)-1,3-thiazol-2-yl]-1-phenylethyl]acetamide is sourced from PubChem (CID 46947978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).