3-bromo-N-(1-thiophen-3-ylethyl)pyridin-2-amine

C11H11BrN2S — CID 62840685

IUPAC3-bromo-N-(1-thiophen-3-ylethyl)pyridin-2-amine
SMILESCC(Nc1ncccc1Br)c1ccsc1
InChIInChI=1S/C11H11BrN2S/c1-8(9-4-6-15-7-9)14-11-10(12)3-2-5-13-11/h2-8H,1H3,(H,13,14)
InChIKeyHMJCZQPERQSSLM-UHFFFAOYSA-N
MW283.19 g/mol
LogP4.08
Rot. Bonds3

About 3-bromo-N-(1-thiophen-3-ylethyl)pyridin-2-amine

3-bromo-N-(1-thiophen-3-ylethyl)pyridin-2-amine (PubChem CID 62840685) has the molecular formula C11H11BrN2S and a molecular weight of 283.19 g/mol. Its IUPAC name is 3-bromo-N-(1-thiophen-3-ylethyl)pyridin-2-amine.

Molecular Properties

Compound Name3-bromo-N-(1-thiophen-3-ylethyl)pyridin-2-amine
PubChem CID62840685
Molecular FormulaC11H11BrN2S
Molecular Weight283.19 g/mol
Exact Mass281.98
IUPAC Name3-bromo-N-(1-thiophen-3-ylethyl)pyridin-2-amine
SMILESCC(Nc1ncccc1Br)c1ccsc1
InChIInChI=1S/C11H11BrN2S/c1-8(9-4-6-15-7-9)14-11-10(12)3-2-5-13-11/h2-8H,1H3,(H,13,14)
InChIKeyHMJCZQPERQSSLM-UHFFFAOYSA-N
XLogP4.08
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.19
LogP ≤ 54.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-bromo-N-[1-(thiadiazol-4-yl)ethyl]pyridin-2-amine
CID 131057699
N-(1-thiophen-3-ylethyl)pyridin-3-amine
CID 62090458
3-bromo-N-[1-(3,4-dimethoxyphenyl)ethyl]pyridin-2-amine
CID 61374280
3-bromo-N-thiophen-3-ylpyridin-2-amine
CID 66353988
3-bromo-N-butan-2-ylpyridin-2-amine
CID 61374838
3-fluoro-2-(1-thiophen-3-ylethylamino)pyridine-4-carboxylic acid
CID 105382273
N-(1-thiophen-3-ylethyl)aniline
CID 62090283
N-(1-pyridin-2-ylethyl)-1-thiophen-3-ylethanamine
CID 62089613
N-(1-thiophen-3-ylethyl)pyrazin-2-amine
CID 62845252
6-chloro-5-methyl-N-(1-thiophen-3-ylethyl)pyrimidin-4-amine
CID 63729190
6-hydrazinyl-5-methyl-N-(1-thiophen-3-ylethyl)pyrimidin-4-amine
CID 80919084
2,5-dichloro-N-(1-thiophen-3-ylethyl)pyrimidin-4-amine
CID 79632615

Frequently Asked Questions

What is the IUPAC name of 3-bromo-N-(1-thiophen-3-ylethyl)pyridin-2-amine?
The IUPAC name of 3-bromo-N-(1-thiophen-3-ylethyl)pyridin-2-amine (CID 62840685) is 3-bromo-N-(1-thiophen-3-ylethyl)pyridin-2-amine.
What is the SMILES notation for 3-bromo-N-(1-thiophen-3-ylethyl)pyridin-2-amine?
The canonical SMILES for 3-bromo-N-(1-thiophen-3-ylethyl)pyridin-2-amine is CC(Nc1ncccc1Br)c1ccsc1.
What is the InChIKey of 3-bromo-N-(1-thiophen-3-ylethyl)pyridin-2-amine?
The InChIKey is HMJCZQPERQSSLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11BrN2S/c1-8(9-4-6-15-7-9)14-11-10(12)3-2-5-13-11/h2-8H,1H3,(H,13,14).
What are the key properties of 3-bromo-N-(1-thiophen-3-ylethyl)pyridin-2-amine?
3-bromo-N-(1-thiophen-3-ylethyl)pyridin-2-amine has a molecular weight of 283.19 g/mol, XLogP of 4.08, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromo-N-(1-thiophen-3-ylethyl)pyridin-2-amine is sourced from PubChem (CID 62840685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).