2-bromo-5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridine;hydrobromide

C7H10Br2N2S — CID 11483833

IUPAC2-bromo-5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridine;hydrobromide
SMILESBr.CN1CCc2nc(Br)sc2C1
InChIInChI=1S/C7H9BrN2S.BrH/c1-10-3-2-5-6(4-10)11-7(8)9-5;/h2-4H2,1H3;1H
InChIKeyBFVHSQSIWIIBOM-UHFFFAOYSA-N
MW314.05 g/mol
LogP2.47
Rot. Bonds

About 2-bromo-5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridine;hydrobromide

2-bromo-5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridine;hydrobromide (PubChem CID 11483833) has the molecular formula C7H10Br2N2S and a molecular weight of 314.05 g/mol. Its IUPAC name is 2-bromo-5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridine;hydrobromide.

Molecular Properties

Compound Name2-bromo-5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridine;hydrobromide
PubChem CID11483833
Molecular FormulaC7H10Br2N2S
Molecular Weight314.05 g/mol
Exact Mass311.89
IUPAC Name2-bromo-5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridine;hydrobromide
SMILESBr.CN1CCc2nc(Br)sc2C1
InChIInChI=1S/C7H9BrN2S.BrH/c1-10-3-2-5-6(4-10)11-7(8)9-5;/h2-4H2,1H3;1H
InChIKeyBFVHSQSIWIIBOM-UHFFFAOYSA-N
XLogP2.47
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.05
LogP ≤ 52.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-amine;molecular fluorine;hydrofluoride
CID 157311752
CID 112708599
CID 112708599
1-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)propan-2-amine
CID 62651951
2,2-dimethyl-1-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)propan-1-one
CID 83388806
2-amino-2-methyl-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)propanamide
CID 110460913
2-amino-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)acetamide
CID 39177210
3-bromo-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)benzamide
CID 27421670
1,1-diethyl-3-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)urea
CID 47433636
2-[4-(cyclohexylmethyl)piperazin-1-yl]-5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridine
CID 91913671
N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-2-oxo-2-piperidin-1-ylacetamide
CID 108517269
N-[(E)-2-aminoprop-1-enyl]-5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridine-2-carboxamide
CID 66786120
lithium;hydride;5-methyl-4,6,7,8-tetrahydro-[1,3]thiazolo[5,4-c]azepine-2-carboxylic acid
CID 173095890

Frequently Asked Questions

What is the IUPAC name of 2-bromo-5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridine;hydrobromide?
The IUPAC name of 2-bromo-5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridine;hydrobromide (CID 11483833) is 2-bromo-5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridine;hydrobromide.
What is the SMILES notation for 2-bromo-5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridine;hydrobromide?
The canonical SMILES for 2-bromo-5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridine;hydrobromide is Br.CN1CCc2nc(Br)sc2C1.
What is the InChIKey of 2-bromo-5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridine;hydrobromide?
The InChIKey is BFVHSQSIWIIBOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9BrN2S.BrH/c1-10-3-2-5-6(4-10)11-7(8)9-5;/h2-4H2,1H3;1H.
What are the key properties of 2-bromo-5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridine;hydrobromide?
2-bromo-5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridine;hydrobromide has a molecular weight of 314.05 g/mol, XLogP of 2.47, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridine;hydrobromide is sourced from PubChem (CID 11483833), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).