2-(5-bromo-2-pyridinyl)-N-(5-bromo-1,3-thiazol-2-yl)-2-methylpropanamide

C12H11Br2N3OS — CID 166329305

IUPAC2-(5-bromo-2-pyridinyl)-N-(5-bromo-1,3-thiazol-2-yl)-2-methylpropanamide
SMILESCC(C)(C(=O)Nc1ncc(Br)s1)c1ccc(Br)cn1
InChIInChI=1S/C12H11Br2N3OS/c1-12(2,8-4-3-7(13)5-15-8)10(18)17-11-16-6-9(14)19-11/h3-6H,1-2H3,(H,16,17,18)
InChIKeyVOYRATWXNXOUJJ-UHFFFAOYSA-N
MW405.12 g/mol
LogP3.98
Rot. Bonds3

About 2-(5-bromo-2-pyridinyl)-N-(5-bromo-1,3-thiazol-2-yl)-2-methylpropanamide

2-(5-bromo-2-pyridinyl)-N-(5-bromo-1,3-thiazol-2-yl)-2-methylpropanamide (PubChem CID 166329305) has the molecular formula C12H11Br2N3OS and a molecular weight of 405.12 g/mol. Its IUPAC name is 2-(5-bromo-2-pyridinyl)-N-(5-bromo-1,3-thiazol-2-yl)-2-methylpropanamide.

Molecular Properties

Compound Name2-(5-bromo-2-pyridinyl)-N-(5-bromo-1,3-thiazol-2-yl)-2-methylpropanamide
PubChem CID166329305
Molecular FormulaC12H11Br2N3OS
Molecular Weight405.12 g/mol
Exact Mass402.90
IUPAC Name2-(5-bromo-2-pyridinyl)-N-(5-bromo-1,3-thiazol-2-yl)-2-methylpropanamide
SMILESCC(C)(C(=O)Nc1ncc(Br)s1)c1ccc(Br)cn1
InChIInChI=1S/C12H11Br2N3OS/c1-12(2,8-4-3-7(13)5-15-8)10(18)17-11-16-6-9(14)19-11/h3-6H,1-2H3,(H,16,17,18)
InChIKeyVOYRATWXNXOUJJ-UHFFFAOYSA-N
XLogP3.98
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500405.12
LogP ≤ 53.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-(5-bromo-2-pyridinyl)-N-(5-bromo-1,3-thiazol-2-yl)-2-methylpropanamide 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

N-(5-bromo-1,3-thiazol-2-yl)propanamide
CID 60654828
(2S)-N-(5-bromo-1,3-thiazol-2-yl)-2-(methylamino)propanamide
CID 130563823
N-(5-bromo-1,3-thiazol-2-yl)but-2-enamide
CID 76880215
methyl 2-[(5-bromo-1,3-thiazol-2-yl)amino]-2-oxoacetate
CID 53352081
2-(4-bromophenoxy)-N-(5-bromo-1,3-thiazol-2-yl)acetamide
CID 35524705
N-(5-bromo-1,3-thiazol-2-yl)butanamide
CID 22170788
2-amino-N-(5-bromo-1,3-thiazol-2-yl)acetamide
CID 60785743
2-[(5-bromo-1,3-thiazol-2-yl)carbamoyl-tert-butylamino]acetic acid
CID 79256833
2-[(5-bromo-1,3-thiazol-2-yl)carbamoylamino]-2-methylbutanoic acid
CID 79801262
N-(5-bromo-1,3-thiazol-2-yl)-2,6-difluoro-3-methylbenzamide
CID 82815247
N-(5-bromo-1,3-thiazol-2-yl)-4-propan-2-ylbenzamide
CID 60654890
1-(4-acetylphenyl)-3-(5-bromo-1,3-thiazol-2-yl)urea
CID 61347023

Frequently Asked Questions

What is the IUPAC name of 2-(5-bromo-2-pyridinyl)-N-(5-bromo-1,3-thiazol-2-yl)-2-methylpropanamide?
The IUPAC name of 2-(5-bromo-2-pyridinyl)-N-(5-bromo-1,3-thiazol-2-yl)-2-methylpropanamide (CID 166329305) is 2-(5-bromo-2-pyridinyl)-N-(5-bromo-1,3-thiazol-2-yl)-2-methylpropanamide.
What is the SMILES notation for 2-(5-bromo-2-pyridinyl)-N-(5-bromo-1,3-thiazol-2-yl)-2-methylpropanamide?
The canonical SMILES for 2-(5-bromo-2-pyridinyl)-N-(5-bromo-1,3-thiazol-2-yl)-2-methylpropanamide is CC(C)(C(=O)Nc1ncc(Br)s1)c1ccc(Br)cn1.
What is the InChIKey of 2-(5-bromo-2-pyridinyl)-N-(5-bromo-1,3-thiazol-2-yl)-2-methylpropanamide?
The InChIKey is VOYRATWXNXOUJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11Br2N3OS/c1-12(2,8-4-3-7(13)5-15-8)10(18)17-11-16-6-9(14)19-11/h3-6H,1-2H3,(H,16,17,18).
What are the key properties of 2-(5-bromo-2-pyridinyl)-N-(5-bromo-1,3-thiazol-2-yl)-2-methylpropanamide?
2-(5-bromo-2-pyridinyl)-N-(5-bromo-1,3-thiazol-2-yl)-2-methylpropanamide has a molecular weight of 405.12 g/mol, XLogP of 3.98, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-bromo-2-pyridinyl)-N-(5-bromo-1,3-thiazol-2-yl)-2-methylpropanamide is sourced from PubChem (CID 166329305), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).