5-bromo-2-(3,4,5-trimethylpyrazol-1-yl)pyridin-3-amine

C11H13BrN4 — CID 61224775

IUPAC5-bromo-2-(3,4,5-trimethylpyrazol-1-yl)pyridin-3-amine
SMILESCc1nn(-c2ncc(Br)cc2N)c(C)c1C
InChIInChI=1S/C11H13BrN4/c1-6-7(2)15-16(8(6)3)11-10(13)4-9(12)5-14-11/h4-5H,13H2,1-3H3
InChIKeyOVEPIGPOVOUOFO-UHFFFAOYSA-N
MW281.16 g/mol
LogP2.54
Rot. Bonds1

About 5-bromo-2-(3,4,5-trimethylpyrazol-1-yl)pyridin-3-amine

5-bromo-2-(3,4,5-trimethylpyrazol-1-yl)pyridin-3-amine (PubChem CID 61224775) has the molecular formula C11H13BrN4 and a molecular weight of 281.16 g/mol. Its IUPAC name is 5-bromo-2-(3,4,5-trimethylpyrazol-1-yl)pyridin-3-amine.

Molecular Properties

Compound Name5-bromo-2-(3,4,5-trimethylpyrazol-1-yl)pyridin-3-amine
PubChem CID61224775
Molecular FormulaC11H13BrN4
Molecular Weight281.16 g/mol
Exact Mass280.03
IUPAC Name5-bromo-2-(3,4,5-trimethylpyrazol-1-yl)pyridin-3-amine
SMILESCc1nn(-c2ncc(Br)cc2N)c(C)c1C
InChIInChI=1S/C11H13BrN4/c1-6-7(2)15-16(8(6)3)11-10(13)4-9(12)5-14-11/h4-5H,13H2,1-3H3
InChIKeyOVEPIGPOVOUOFO-UHFFFAOYSA-N
XLogP2.54
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.16
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 5-bromo-2-(3,4,5-trimethylpyrazol-1-yl)pyridin-3-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-bromo-2-(3,4,5-trimethylpyrazol-1-yl)pyridin-3-amine?
The IUPAC name of 5-bromo-2-(3,4,5-trimethylpyrazol-1-yl)pyridin-3-amine (CID 61224775) is 5-bromo-2-(3,4,5-trimethylpyrazol-1-yl)pyridin-3-amine.
What is the SMILES notation for 5-bromo-2-(3,4,5-trimethylpyrazol-1-yl)pyridin-3-amine?
The canonical SMILES for 5-bromo-2-(3,4,5-trimethylpyrazol-1-yl)pyridin-3-amine is Cc1nn(-c2ncc(Br)cc2N)c(C)c1C.
What is the InChIKey of 5-bromo-2-(3,4,5-trimethylpyrazol-1-yl)pyridin-3-amine?
The InChIKey is OVEPIGPOVOUOFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13BrN4/c1-6-7(2)15-16(8(6)3)11-10(13)4-9(12)5-14-11/h4-5H,13H2,1-3H3.
What are the key properties of 5-bromo-2-(3,4,5-trimethylpyrazol-1-yl)pyridin-3-amine?
5-bromo-2-(3,4,5-trimethylpyrazol-1-yl)pyridin-3-amine has a molecular weight of 281.16 g/mol, XLogP of 2.54, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-2-(3,4,5-trimethylpyrazol-1-yl)pyridin-3-amine is sourced from PubChem (CID 61224775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).