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

C11H16BrClN2 — CID 103582444

IUPAC5-bromo-3-chloro-N-(2-methylpentan-3-yl)pyridin-2-amine
SMILESCCC(Nc1ncc(Br)cc1Cl)C(C)C
InChIInChI=1S/C11H16BrClN2/c1-4-10(7(2)3)15-11-9(13)5-8(12)6-14-11/h5-7,10H,4H2,1-3H3,(H,14,15)
InChIKeyNPUQBAWSTGLBNZ-UHFFFAOYSA-N
MW291.62 g/mol
LogP4.34
Rot. Bonds4

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

5-bromo-3-chloro-N-(2-methylpentan-3-yl)pyridin-2-amine (PubChem CID 103582444) has the molecular formula C11H16BrClN2 and a molecular weight of 291.62 g/mol. Its IUPAC name is 5-bromo-3-chloro-N-(2-methylpentan-3-yl)pyridin-2-amine.

Molecular Properties

Compound Name5-bromo-3-chloro-N-(2-methylpentan-3-yl)pyridin-2-amine
PubChem CID103582444
Molecular FormulaC11H16BrClN2
Molecular Weight291.62 g/mol
Exact Mass290.02
IUPAC Name5-bromo-3-chloro-N-(2-methylpentan-3-yl)pyridin-2-amine
SMILESCCC(Nc1ncc(Br)cc1Cl)C(C)C
InChIInChI=1S/C11H16BrClN2/c1-4-10(7(2)3)15-11-9(13)5-8(12)6-14-11/h5-7,10H,4H2,1-3H3,(H,14,15)
InChIKeyNPUQBAWSTGLBNZ-UHFFFAOYSA-N
XLogP4.34
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.62
LogP ≤ 54.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-bromo-3-chloro-N-(1-ethoxy-3-methylbutan-2-yl)pyridin-2-amine
CID 103580433
5-bromo-N-but-3-yn-2-yl-3-chloropyridin-2-amine
CID 103582656
3-bromo-5-chloro-N-(2-methylpentan-3-yl)pyridin-2-amine
CID 114835785
5-bromo-3-chloro-N-(1-chloropropan-2-yl)pyridin-2-amine
CID 103584101
5-bromo-3-chloro-N-(1-ethylsulfanylpropan-2-yl)pyridin-2-amine
CID 103582641
(2S)-2-[(5-bromo-3-chloro-2-pyridinyl)amino]-3-methylbutanoic acid
CID 122049570
5-bromo-3-chloro-N-(1-cyclopropylbutan-2-yl)pyridin-2-amine
CID 103582526
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
2-[(5-bromo-3-chloro-2-pyridinyl)amino]propanamide
CID 103582387
5-bromo-3-chloro-N-propylpyridin-2-amine
CID 82480708
5-bromo-3-chloro-N-(1-methoxypentan-2-yl)pyridin-2-amine
CID 103582537

Frequently Asked Questions

What is the IUPAC name of 5-bromo-3-chloro-N-(2-methylpentan-3-yl)pyridin-2-amine?
The IUPAC name of 5-bromo-3-chloro-N-(2-methylpentan-3-yl)pyridin-2-amine (CID 103582444) is 5-bromo-3-chloro-N-(2-methylpentan-3-yl)pyridin-2-amine.
What is the SMILES notation for 5-bromo-3-chloro-N-(2-methylpentan-3-yl)pyridin-2-amine?
The canonical SMILES for 5-bromo-3-chloro-N-(2-methylpentan-3-yl)pyridin-2-amine is CCC(Nc1ncc(Br)cc1Cl)C(C)C.
What is the InChIKey of 5-bromo-3-chloro-N-(2-methylpentan-3-yl)pyridin-2-amine?
The InChIKey is NPUQBAWSTGLBNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16BrClN2/c1-4-10(7(2)3)15-11-9(13)5-8(12)6-14-11/h5-7,10H,4H2,1-3H3,(H,14,15).
What are the key properties of 5-bromo-3-chloro-N-(2-methylpentan-3-yl)pyridin-2-amine?
5-bromo-3-chloro-N-(2-methylpentan-3-yl)pyridin-2-amine has a molecular weight of 291.62 g/mol, XLogP of 4.34, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-3-chloro-N-(2-methylpentan-3-yl)pyridin-2-amine is sourced from PubChem (CID 103582444), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).