5-bromo-N-tert-butyl-N,3-dimethylpyridin-2-amine

C11H17BrN2 — CID 115148475

IUPAC5-bromo-N-tert-butyl-N,3-dimethylpyridin-2-amine
SMILESCc1cc(Br)cnc1N(C)C(C)(C)C
InChIInChI=1S/C11H17BrN2/c1-8-6-9(12)7-13-10(8)14(5)11(2,3)4/h6-7H,1-5H3
InChIKeyOQZGLGGLZBNKGB-UHFFFAOYSA-N
MW257.18 g/mol
LogP3.39
Rot. Bonds1

About 5-bromo-N-tert-butyl-N,3-dimethylpyridin-2-amine

5-bromo-N-tert-butyl-N,3-dimethylpyridin-2-amine (PubChem CID 115148475) has the molecular formula C11H17BrN2 and a molecular weight of 257.18 g/mol. Its IUPAC name is 5-bromo-N-tert-butyl-N,3-dimethylpyridin-2-amine.

Molecular Properties

Compound Name5-bromo-N-tert-butyl-N,3-dimethylpyridin-2-amine
PubChem CID115148475
Molecular FormulaC11H17BrN2
Molecular Weight257.18 g/mol
Exact Mass256.06
IUPAC Name5-bromo-N-tert-butyl-N,3-dimethylpyridin-2-amine
SMILESCc1cc(Br)cnc1N(C)C(C)(C)C
InChIInChI=1S/C11H17BrN2/c1-8-6-9(12)7-13-10(8)14(5)11(2,3)4/h6-7H,1-5H3
InChIKeyOQZGLGGLZBNKGB-UHFFFAOYSA-N
XLogP3.39
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.18
LogP ≤ 53.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

5-bromo-N-tert-butyl-N,3-dimethylpyridine-2-carboxamide
CID 70896534
N'-(2-aminoethyl)-N'-(5-bromo-3-methyl-2-pyridinyl)ethane-1,2-diamine
CID 79717838
5-bromo-N-tert-butyl-N,4-dimethylpyridin-2-amine
CID 115147028
5-bromo-N-tert-butyl-N,2-dimethylpyrimidin-4-amine
CID 130654167
5-bromo-N-[(2,5-dimethylphenyl)methyl]-N,3-dimethylpyridin-2-amine
CID 115148609
5-bromo-N-(4-methoxy-3-methylphenyl)-N,3-dimethylpyridin-2-amine
CID 115148484
N-[4-(aminomethyl)phenyl]-5-bromo-N,3-dimethylpyridin-2-amine
CID 79712553
5-bromo-N,3-dimethyl-N-[2-(4-methylphenyl)ethyl]pyridin-2-amine
CID 115148671
5-bromo-N,3-dimethyl-N-naphthalen-2-ylpyridin-2-amine
CID 115148547
5-bromo-N-(2-chloroethyl)-3-methyl-N-(2,2,2-trifluoroethyl)pyridin-2-amine
CID 107490631
5-bromo-N-(2-methoxy-5-methylphenyl)-N,3-dimethylpyridin-2-amine
CID 115148485
ethyl 2-[(5-bromo-3-methyl-2-pyridinyl)-methylamino]acetate
CID 79718647

Frequently Asked Questions

What is the IUPAC name of 5-bromo-N-tert-butyl-N,3-dimethylpyridin-2-amine?
The IUPAC name of 5-bromo-N-tert-butyl-N,3-dimethylpyridin-2-amine (CID 115148475) is 5-bromo-N-tert-butyl-N,3-dimethylpyridin-2-amine.
What is the SMILES notation for 5-bromo-N-tert-butyl-N,3-dimethylpyridin-2-amine?
The canonical SMILES for 5-bromo-N-tert-butyl-N,3-dimethylpyridin-2-amine is Cc1cc(Br)cnc1N(C)C(C)(C)C.
What is the InChIKey of 5-bromo-N-tert-butyl-N,3-dimethylpyridin-2-amine?
The InChIKey is OQZGLGGLZBNKGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17BrN2/c1-8-6-9(12)7-13-10(8)14(5)11(2,3)4/h6-7H,1-5H3.
What are the key properties of 5-bromo-N-tert-butyl-N,3-dimethylpyridin-2-amine?
5-bromo-N-tert-butyl-N,3-dimethylpyridin-2-amine has a molecular weight of 257.18 g/mol, XLogP of 3.39, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N-tert-butyl-N,3-dimethylpyridin-2-amine is sourced from PubChem (CID 115148475), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).