N-(4-methyl-2-pyridinyl)-2-(4-methyl-1,3-thiazol-2-yl)acetamide

C12H13N3OS — CID 110484461

IUPACN-(4-methyl-2-pyridinyl)-2-(4-methyl-1,3-thiazol-2-yl)acetamide
SMILESCc1ccnc(NC(=O)Cc2nc(C)cs2)c1
InChIInChI=1S/C12H13N3OS/c1-8-3-4-13-10(5-8)15-11(16)6-12-14-9(2)7-17-12/h3-5,7H,6H2,1-2H3,(H,13,15,16)
InChIKeyGUKVNQYOZJKRCU-UHFFFAOYSA-N
MW247.32 g/mol
LogP2.34
Rot. Bonds3

About N-(4-methyl-2-pyridinyl)-2-(4-methyl-1,3-thiazol-2-yl)acetamide

N-(4-methyl-2-pyridinyl)-2-(4-methyl-1,3-thiazol-2-yl)acetamide (PubChem CID 110484461) has the molecular formula C12H13N3OS and a molecular weight of 247.32 g/mol. Its IUPAC name is N-(4-methyl-2-pyridinyl)-2-(4-methyl-1,3-thiazol-2-yl)acetamide.

Molecular Properties

Compound NameN-(4-methyl-2-pyridinyl)-2-(4-methyl-1,3-thiazol-2-yl)acetamide
PubChem CID110484461
Molecular FormulaC12H13N3OS
Molecular Weight247.32 g/mol
Exact Mass247.08
IUPAC NameN-(4-methyl-2-pyridinyl)-2-(4-methyl-1,3-thiazol-2-yl)acetamide
SMILESCc1ccnc(NC(=O)Cc2nc(C)cs2)c1
InChIInChI=1S/C12H13N3OS/c1-8-3-4-13-10(5-8)15-11(16)6-12-14-9(2)7-17-12/h3-5,7H,6H2,1-2H3,(H,13,15,16)
InChIKeyGUKVNQYOZJKRCU-UHFFFAOYSA-N
XLogP2.34
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.32
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(4-methyl-2-pyridinyl)-2-(4-methyl-1,3-thiazol-2-yl)acetamide?
The IUPAC name of N-(4-methyl-2-pyridinyl)-2-(4-methyl-1,3-thiazol-2-yl)acetamide (CID 110484461) is N-(4-methyl-2-pyridinyl)-2-(4-methyl-1,3-thiazol-2-yl)acetamide.
What is the SMILES notation for N-(4-methyl-2-pyridinyl)-2-(4-methyl-1,3-thiazol-2-yl)acetamide?
The canonical SMILES for N-(4-methyl-2-pyridinyl)-2-(4-methyl-1,3-thiazol-2-yl)acetamide is Cc1ccnc(NC(=O)Cc2nc(C)cs2)c1.
What is the InChIKey of N-(4-methyl-2-pyridinyl)-2-(4-methyl-1,3-thiazol-2-yl)acetamide?
The InChIKey is GUKVNQYOZJKRCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13N3OS/c1-8-3-4-13-10(5-8)15-11(16)6-12-14-9(2)7-17-12/h3-5,7H,6H2,1-2H3,(H,13,15,16).
What are the key properties of N-(4-methyl-2-pyridinyl)-2-(4-methyl-1,3-thiazol-2-yl)acetamide?
N-(4-methyl-2-pyridinyl)-2-(4-methyl-1,3-thiazol-2-yl)acetamide has a molecular weight of 247.32 g/mol, XLogP of 2.34, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methyl-2-pyridinyl)-2-(4-methyl-1,3-thiazol-2-yl)acetamide is sourced from PubChem (CID 110484461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).