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

C11H11BrN2S — CID 61474378

IUPAC3-bromo-N-(2-thiophen-3-ylethyl)pyridin-2-amine
SMILESBrc1cccnc1NCCc1ccsc1
InChIInChI=1S/C11H11BrN2S/c12-10-2-1-5-13-11(10)14-6-3-9-4-7-15-8-9/h1-2,4-5,7-8H,3,6H2,(H,13,14)
InChIKeyNIAFPXXUYUZWRP-UHFFFAOYSA-N
MW283.19 g/mol
LogP3.56
Rot. Bonds4

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

3-bromo-N-(2-thiophen-3-ylethyl)pyridin-2-amine (PubChem CID 61474378) has the molecular formula C11H11BrN2S and a molecular weight of 283.19 g/mol. Its IUPAC name is 3-bromo-N-(2-thiophen-3-ylethyl)pyridin-2-amine.

Molecular Properties

Compound Name3-bromo-N-(2-thiophen-3-ylethyl)pyridin-2-amine
PubChem CID61474378
Molecular FormulaC11H11BrN2S
Molecular Weight283.19 g/mol
Exact Mass281.98
IUPAC Name3-bromo-N-(2-thiophen-3-ylethyl)pyridin-2-amine
SMILESBrc1cccnc1NCCc1ccsc1
InChIInChI=1S/C11H11BrN2S/c12-10-2-1-5-13-11(10)14-6-3-9-4-7-15-8-9/h1-2,4-5,7-8H,3,6H2,(H,13,14)
InChIKeyNIAFPXXUYUZWRP-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

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Related Compounds

2-[(3-bromo-2-pyridinyl)amino]ethanol
CID 61374645
3-bromo-N-thiophen-3-ylpyridin-2-amine
CID 66353988
3-bromo-N-(3-chloropropyl)pyridin-2-amine
CID 65029830
6-bromo-N-(2-thiophen-3-ylethyl)pyridin-2-amine
CID 63962803
3-bromo-N-(4-chlorobutyl)pyridin-2-amine
CID 86240809
3-bromo-N-[2-(1H-1,2,4-triazol-5-yl)ethyl]pyridin-2-amine
CID 64530464
5-chloro-N-(2-thiophen-3-ylethyl)pyrimidin-4-amine
CID 105369294
N-benzyl-3-bromopyridin-2-amine
CID 11708714
1-propyl-3-(2-thiophen-3-ylethylamino)pyrazin-2-one
CID 55154883
2-chloro-N-(2-thiophen-3-ylethyl)pyridine-3-sulfonamide
CID 54953527
N'-(3-bromo-2-pyridinyl)hexane-1,6-diamine
CID 107845203
N-(2-thiophen-3-ylethyl)pyrimidine-2-carboxamide
CID 170939358

Frequently Asked Questions

What is the IUPAC name of 3-bromo-N-(2-thiophen-3-ylethyl)pyridin-2-amine?
The IUPAC name of 3-bromo-N-(2-thiophen-3-ylethyl)pyridin-2-amine (CID 61474378) is 3-bromo-N-(2-thiophen-3-ylethyl)pyridin-2-amine.
What is the SMILES notation for 3-bromo-N-(2-thiophen-3-ylethyl)pyridin-2-amine?
The canonical SMILES for 3-bromo-N-(2-thiophen-3-ylethyl)pyridin-2-amine is Brc1cccnc1NCCc1ccsc1.
What is the InChIKey of 3-bromo-N-(2-thiophen-3-ylethyl)pyridin-2-amine?
The InChIKey is NIAFPXXUYUZWRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11BrN2S/c12-10-2-1-5-13-11(10)14-6-3-9-4-7-15-8-9/h1-2,4-5,7-8H,3,6H2,(H,13,14).
What are the key properties of 3-bromo-N-(2-thiophen-3-ylethyl)pyridin-2-amine?
3-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 3-bromo-N-(2-thiophen-3-ylethyl)pyridin-2-amine is sourced from PubChem (CID 61474378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).