2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[2-(5-methylthiophen-2-yl)-3-pyridinyl]acetamide

C17H17N3O2S — CID 99823514

IUPAC2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[2-(5-methylthiophen-2-yl)-3-pyridinyl]acetamide
SMILESCc1ccc(-c2ncccc2NC(=O)Cc2c(C)noc2C)s1
InChIInChI=1S/C17H17N3O2S/c1-10-6-7-15(23-10)17-14(5-4-8-18-17)19-16(21)9-13-11(2)20-22-12(13)3/h4-8H,9H2,1-3H3,(H,19,21)
InChIKeyGTXNJOFMPRRJDS-UHFFFAOYSA-N
MW327.41 g/mol
LogP3.90
Rot. Bonds4

About 2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[2-(5-methylthiophen-2-yl)-3-pyridinyl]acetamide

2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[2-(5-methylthiophen-2-yl)-3-pyridinyl]acetamide (PubChem CID 99823514) has the molecular formula C17H17N3O2S and a molecular weight of 327.41 g/mol. Its IUPAC name is 2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[2-(5-methylthiophen-2-yl)-3-pyridinyl]acetamide.

Molecular Properties

Compound Name2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[2-(5-methylthiophen-2-yl)-3-pyridinyl]acetamide
PubChem CID99823514
Molecular FormulaC17H17N3O2S
Molecular Weight327.41 g/mol
Exact Mass327.10
IUPAC Name2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[2-(5-methylthiophen-2-yl)-3-pyridinyl]acetamide
SMILESCc1ccc(-c2ncccc2NC(=O)Cc2c(C)noc2C)s1
InChIInChI=1S/C17H17N3O2S/c1-10-6-7-15(23-10)17-14(5-4-8-18-17)19-16(21)9-13-11(2)20-22-12(13)3/h4-8H,9H2,1-3H3,(H,19,21)
InChIKeyGTXNJOFMPRRJDS-UHFFFAOYSA-N
XLogP3.90
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.41
LogP ≤ 53.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[2-(methylaminomethyl)phenyl]acetamide
CID 43601046
2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(4-methyl-5-pyridin-2-yl-1,3-thiazol-2-yl)acetamide
CID 31156282
2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(4-methyl-2-pyridinyl)acetamide
CID 17417848
2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(6-methyl-2-pyridinyl)acetamide
CID 18107240
N-(5-chloro-2-methylphenyl)-2-(3,5-dimethyl-1,2-oxazol-4-yl)acetamide
CID 30275732
N-(2,5-dimethoxyphenyl)-2-(3,5-dimethyl-1,2-oxazol-4-yl)acetamide
CID 30273731
N-tert-butyl-3-[[2-(3,5-dimethyl-1,2-oxazol-4-yl)acetyl]amino]-2-methylbenzamide
CID 131899695
2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(2-fluoro-4-hydroxyphenyl)acetamide
CID 86787189
N-(4-bromo-2-fluorophenyl)-2-(3,5-dimethyl-1,2-oxazol-4-yl)acetamide
CID 45495096
N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-2-(3,5-dimethyl-1,2-oxazol-4-yl)acetamide
CID 29169894
2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(5-methyl-1H-pyrazol-3-yl)acetamide
CID 47215907
2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[3-[(E)-2-pyridin-2-ylethenyl]phenyl]acetamide
CID 8832165

Frequently Asked Questions

What is the IUPAC name of 2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[2-(5-methylthiophen-2-yl)-3-pyridinyl]acetamide?
The IUPAC name of 2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[2-(5-methylthiophen-2-yl)-3-pyridinyl]acetamide (CID 99823514) is 2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[2-(5-methylthiophen-2-yl)-3-pyridinyl]acetamide.
What is the SMILES notation for 2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[2-(5-methylthiophen-2-yl)-3-pyridinyl]acetamide?
The canonical SMILES for 2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[2-(5-methylthiophen-2-yl)-3-pyridinyl]acetamide is Cc1ccc(-c2ncccc2NC(=O)Cc2c(C)noc2C)s1.
What is the InChIKey of 2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[2-(5-methylthiophen-2-yl)-3-pyridinyl]acetamide?
The InChIKey is GTXNJOFMPRRJDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N3O2S/c1-10-6-7-15(23-10)17-14(5-4-8-18-17)19-16(21)9-13-11(2)20-22-12(13)3/h4-8H,9H2,1-3H3,(H,19,21).
What are the key properties of 2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[2-(5-methylthiophen-2-yl)-3-pyridinyl]acetamide?
2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[2-(5-methylthiophen-2-yl)-3-pyridinyl]acetamide has a molecular weight of 327.41 g/mol, XLogP of 3.90, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[2-(5-methylthiophen-2-yl)-3-pyridinyl]acetamide is sourced from PubChem (CID 99823514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).