2-methyl-N-[3-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]propanamide

C16H17N3OS — CID 7151266

IUPAC2-methyl-N-[3-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]propanamide
SMILESCc1csc2nc(-c3cccc(NC(=O)C(C)C)c3)cn12
InChIInChI=1S/C16H17N3OS/c1-10(2)15(20)17-13-6-4-5-12(7-13)14-8-19-11(3)9-21-16(19)18-14/h4-10H,1-3H3,(H,17,20)
InChIKeyPCIGIDTTZZLYTI-UHFFFAOYSA-N
MW299.40 g/mol
LogP3.97
Rot. Bonds3

About 2-methyl-N-[3-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]propanamide

2-methyl-N-[3-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]propanamide (PubChem CID 7151266) has the molecular formula C16H17N3OS and a molecular weight of 299.40 g/mol. Its IUPAC name is 2-methyl-N-[3-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]propanamide.

Molecular Properties

Compound Name2-methyl-N-[3-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]propanamide
PubChem CID7151266
Molecular FormulaC16H17N3OS
Molecular Weight299.40 g/mol
Exact Mass299.11
IUPAC Name2-methyl-N-[3-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]propanamide
SMILESCc1csc2nc(-c3cccc(NC(=O)C(C)C)c3)cn12
InChIInChI=1S/C16H17N3OS/c1-10(2)15(20)17-13-6-4-5-12(7-13)14-8-19-11(3)9-21-16(19)18-14/h4-10H,1-3H3,(H,17,20)
InChIKeyPCIGIDTTZZLYTI-UHFFFAOYSA-N
XLogP3.97
TPSA46.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.40
LogP ≤ 53.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[3-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]propanamide?
The IUPAC name of 2-methyl-N-[3-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]propanamide (CID 7151266) is 2-methyl-N-[3-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]propanamide.
What is the SMILES notation for 2-methyl-N-[3-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]propanamide?
The canonical SMILES for 2-methyl-N-[3-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]propanamide is Cc1csc2nc(-c3cccc(NC(=O)C(C)C)c3)cn12.
What is the InChIKey of 2-methyl-N-[3-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]propanamide?
The InChIKey is PCIGIDTTZZLYTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3OS/c1-10(2)15(20)17-13-6-4-5-12(7-13)14-8-19-11(3)9-21-16(19)18-14/h4-10H,1-3H3,(H,17,20).
What are the key properties of 2-methyl-N-[3-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]propanamide?
2-methyl-N-[3-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]propanamide has a molecular weight of 299.40 g/mol, XLogP of 3.97, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[3-(3-methylimidazo[2,1-b][1,3]thiazol-6-yl)phenyl]propanamide is sourced from PubChem (CID 7151266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).