6-bromo-N-(2-thiophen-3-ylethyl)pyridin-2-amine

C11H11BrN2S — CID 63962803

IUPAC6-bromo-N-(2-thiophen-3-ylethyl)pyridin-2-amine
SMILESBrc1cccc(NCCc2ccsc2)n1
InChIInChI=1S/C11H11BrN2S/c12-10-2-1-3-11(14-10)13-6-4-9-5-7-15-8-9/h1-3,5,7-8H,4,6H2,(H,13,14)
InChIKeyUSRAAXBEBQARLM-UHFFFAOYSA-N
MW283.19 g/mol
LogP3.56
Rot. Bonds4

About 6-bromo-N-(2-thiophen-3-ylethyl)pyridin-2-amine

6-bromo-N-(2-thiophen-3-ylethyl)pyridin-2-amine (PubChem CID 63962803) has the molecular formula C11H11BrN2S and a molecular weight of 283.19 g/mol. Its IUPAC name is 6-bromo-N-(2-thiophen-3-ylethyl)pyridin-2-amine.

Molecular Properties

Compound Name6-bromo-N-(2-thiophen-3-ylethyl)pyridin-2-amine
PubChem CID63962803
Molecular FormulaC11H11BrN2S
Molecular Weight283.19 g/mol
Exact Mass281.98
IUPAC Name6-bromo-N-(2-thiophen-3-ylethyl)pyridin-2-amine
SMILESBrc1cccc(NCCc2ccsc2)n1
InChIInChI=1S/C11H11BrN2S/c12-10-2-1-3-11(14-10)13-6-4-9-5-7-15-8-9/h1-3,5,7-8H,4,6H2,(H,13,14)
InChIKeyUSRAAXBEBQARLM-UHFFFAOYSA-N
XLogP3.56
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.19
LogP ≤ 53.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

2-propan-2-yl-6-N-propyl-4-N-(2-thiophen-3-ylethyl)pyrimidine-4,6-diamine
CID 80961771
3-bromo-N-(2-thiophen-3-ylethyl)pyridin-2-amine
CID 61474378
6-bromo-N-[2-(2-fluorophenyl)ethyl]pyridin-2-amine
CID 63963216
3-chloro-N-(2-thiophen-3-ylethyl)-1,2,4-triazin-5-amine
CID 115000535
2-phenyl-4-N-(2-thiophen-3-ylethyl)pyrimidine-4,6-diamine
CID 115915460
6-N,2-diethyl-4-N-(2-thiophen-3-ylethyl)pyrimidine-4,6-diamine
CID 80935379
6-hydrazinyl-N-(2-thiophen-3-ylethyl)pyrimidin-4-amine
CID 80897852
6-propoxy-2-N-(2-thiophen-3-ylethyl)pyridine-2,5-diamine
CID 61474843
2-chloro-6-(2-thiophen-3-ylethylamino)pyridine-4-carbonitrile
CID 83074490
6-chloro-N-(2-thiophen-3-ylethyl)-4-(trifluoromethyl)pyridin-2-amine
CID 102715638
2-N-(2-thiophen-3-ylethyl)-1,3-benzoxazole-2,4-diamine
CID 79892898
6-N-ethyl-4-N-(2-thiophen-3-ylethyl)-2-(trifluoromethyl)pyrimidine-4,6-diamine
CID 106771223

Frequently Asked Questions

What is the IUPAC name of 6-bromo-N-(2-thiophen-3-ylethyl)pyridin-2-amine?
The IUPAC name of 6-bromo-N-(2-thiophen-3-ylethyl)pyridin-2-amine (CID 63962803) is 6-bromo-N-(2-thiophen-3-ylethyl)pyridin-2-amine.
What is the SMILES notation for 6-bromo-N-(2-thiophen-3-ylethyl)pyridin-2-amine?
The canonical SMILES for 6-bromo-N-(2-thiophen-3-ylethyl)pyridin-2-amine is Brc1cccc(NCCc2ccsc2)n1.
What is the InChIKey of 6-bromo-N-(2-thiophen-3-ylethyl)pyridin-2-amine?
The InChIKey is USRAAXBEBQARLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11BrN2S/c12-10-2-1-3-11(14-10)13-6-4-9-5-7-15-8-9/h1-3,5,7-8H,4,6H2,(H,13,14).
What are the key properties of 6-bromo-N-(2-thiophen-3-ylethyl)pyridin-2-amine?
6-bromo-N-(2-thiophen-3-ylethyl)pyridin-2-amine has a molecular weight of 283.19 g/mol, XLogP of 3.56, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-N-(2-thiophen-3-ylethyl)pyridin-2-amine is sourced from PubChem (CID 63962803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).