5-bromo-3-chloro-N-(1-ethylsulfanylpropan-2-yl)pyridin-2-amine

C10H14BrClN2S — CID 103582641

IUPAC5-bromo-3-chloro-N-(1-ethylsulfanylpropan-2-yl)pyridin-2-amine
SMILESCCSCC(C)Nc1ncc(Br)cc1Cl
InChIInChI=1S/C10H14BrClN2S/c1-3-15-6-7(2)14-10-9(12)4-8(11)5-13-10/h4-5,7H,3,6H2,1-2H3,(H,13,14)
InChIKeyKFPDNOFGLPXICA-UHFFFAOYSA-N
MW309.66 g/mol
LogP4.05
Rot. Bonds5

About 5-bromo-3-chloro-N-(1-ethylsulfanylpropan-2-yl)pyridin-2-amine

5-bromo-3-chloro-N-(1-ethylsulfanylpropan-2-yl)pyridin-2-amine (PubChem CID 103582641) has the molecular formula C10H14BrClN2S and a molecular weight of 309.66 g/mol. Its IUPAC name is 5-bromo-3-chloro-N-(1-ethylsulfanylpropan-2-yl)pyridin-2-amine.

Molecular Properties

Compound Name5-bromo-3-chloro-N-(1-ethylsulfanylpropan-2-yl)pyridin-2-amine
PubChem CID103582641
Molecular FormulaC10H14BrClN2S
Molecular Weight309.66 g/mol
Exact Mass307.97
IUPAC Name5-bromo-3-chloro-N-(1-ethylsulfanylpropan-2-yl)pyridin-2-amine
SMILESCCSCC(C)Nc1ncc(Br)cc1Cl
InChIInChI=1S/C10H14BrClN2S/c1-3-15-6-7(2)14-10-9(12)4-8(11)5-13-10/h4-5,7H,3,6H2,1-2H3,(H,13,14)
InChIKeyKFPDNOFGLPXICA-UHFFFAOYSA-N
XLogP4.05
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.66
LogP ≤ 54.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-bromo-3-chloro-N-(1-chloropropan-2-yl)pyridin-2-amine
CID 103584101
3,5-dichloro-N-(1-ethylsulfanylpropan-2-yl)-6-hydrazinylpyridin-2-amine
CID 102762611
5-bromo-3-chloro-N-(2-methylpentan-3-yl)pyridin-2-amine
CID 103582444
5-bromo-3-chloro-N-[(2S)-1-[(R)-methylsulfinyl]propan-2-yl]pyridin-2-amine
CID 124681216
5-bromo-3-chloro-N-[(2R)-1-[(S)-methylsulfinyl]propan-2-yl]pyridin-2-amine
CID 124681252
5-bromo-3-chloro-N-[1-(4-fluorophenyl)propan-2-yl]pyridin-2-amine
CID 103582511
5-bromo-3-chloro-N-(1-imidazol-1-ylpropan-2-yl)pyridin-2-amine
CID 103582451
5-bromo-N-but-3-yn-2-yl-3-chloropyridin-2-amine
CID 103582656
5-bromo-3-chloro-N-(1-ethoxy-3-methylbutan-2-yl)pyridin-2-amine
CID 103580433
5-bromo-3-chloro-N-(1-thiophen-3-ylpropan-2-yl)pyridin-2-amine
CID 103582447
2-[(5-bromo-3-chloro-2-pyridinyl)amino]propanamide
CID 103582387
5-bromo-3-chloro-N-propylpyridin-2-amine
CID 82480708

Frequently Asked Questions

What is the IUPAC name of 5-bromo-3-chloro-N-(1-ethylsulfanylpropan-2-yl)pyridin-2-amine?
The IUPAC name of 5-bromo-3-chloro-N-(1-ethylsulfanylpropan-2-yl)pyridin-2-amine (CID 103582641) is 5-bromo-3-chloro-N-(1-ethylsulfanylpropan-2-yl)pyridin-2-amine.
What is the SMILES notation for 5-bromo-3-chloro-N-(1-ethylsulfanylpropan-2-yl)pyridin-2-amine?
The canonical SMILES for 5-bromo-3-chloro-N-(1-ethylsulfanylpropan-2-yl)pyridin-2-amine is CCSCC(C)Nc1ncc(Br)cc1Cl.
What is the InChIKey of 5-bromo-3-chloro-N-(1-ethylsulfanylpropan-2-yl)pyridin-2-amine?
The InChIKey is KFPDNOFGLPXICA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14BrClN2S/c1-3-15-6-7(2)14-10-9(12)4-8(11)5-13-10/h4-5,7H,3,6H2,1-2H3,(H,13,14).
What are the key properties of 5-bromo-3-chloro-N-(1-ethylsulfanylpropan-2-yl)pyridin-2-amine?
5-bromo-3-chloro-N-(1-ethylsulfanylpropan-2-yl)pyridin-2-amine has a molecular weight of 309.66 g/mol, XLogP of 4.05, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-3-chloro-N-(1-ethylsulfanylpropan-2-yl)pyridin-2-amine is sourced from PubChem (CID 103582641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).