6-bromo-N-(3-ethyl-1-methylpyrazol-4-yl)pyridin-2-amine

C11H13BrN4 — CID 107464291

IUPAC6-bromo-N-(3-ethyl-1-methylpyrazol-4-yl)pyridin-2-amine
SMILESCCc1nn(C)cc1Nc1cccc(Br)n1
InChIInChI=1S/C11H13BrN4/c1-3-8-9(7-16(2)15-8)13-11-6-4-5-10(12)14-11/h4-7H,3H2,1-2H3,(H,13,14)
InChIKeyIWNUXLVZUVTJDF-UHFFFAOYSA-N
MW281.16 g/mol
LogP2.88
Rot. Bonds3

About 6-bromo-N-(3-ethyl-1-methylpyrazol-4-yl)pyridin-2-amine

6-bromo-N-(3-ethyl-1-methylpyrazol-4-yl)pyridin-2-amine (PubChem CID 107464291) has the molecular formula C11H13BrN4 and a molecular weight of 281.16 g/mol. Its IUPAC name is 6-bromo-N-(3-ethyl-1-methylpyrazol-4-yl)pyridin-2-amine.

Molecular Properties

Compound Name6-bromo-N-(3-ethyl-1-methylpyrazol-4-yl)pyridin-2-amine
PubChem CID107464291
Molecular FormulaC11H13BrN4
Molecular Weight281.16 g/mol
Exact Mass280.03
IUPAC Name6-bromo-N-(3-ethyl-1-methylpyrazol-4-yl)pyridin-2-amine
SMILESCCc1nn(C)cc1Nc1cccc(Br)n1
InChIInChI=1S/C11H13BrN4/c1-3-8-9(7-16(2)15-8)13-11-6-4-5-10(12)14-11/h4-7H,3H2,1-2H3,(H,13,14)
InChIKeyIWNUXLVZUVTJDF-UHFFFAOYSA-N
XLogP2.88
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.16
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Analyze 6-bromo-N-(3-ethyl-1-methylpyrazol-4-yl)pyridin-2-amine with MolForge

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

Launch Full Analysis

Related Compounds

N-(3-ethyl-1-methylpyrazol-4-yl)-6-methylpyridin-2-amine
CID 107463689
4-bromo-N-(3-ethyl-1-methylpyrazol-4-yl)-1,3-thiazol-2-amine
CID 107463531
2-N-ethyl-4-N-(3-ethyl-1-methylpyrazol-4-yl)pyrimidine-2,4-diamine
CID 107465221
N-(3-ethyl-1-methylpyrazol-4-yl)-6-methylpyridazin-3-amine
CID 107463688
2-N-(3-ethyl-1-methylpyrazol-4-yl)pyrazine-2,6-diamine
CID 107465113
N-(3-ethyl-1-methylpyrazol-4-yl)-6-hydrazinylpyrazin-2-amine
CID 107465301
2-bromo-6-[(3-ethyl-1-methylpyrazol-4-yl)amino]benzenecarbothioamide
CID 107463322
6-bromo-N-(3-ethyl-1-methylpyrazol-4-yl)-1,3-benzothiazol-2-amine
CID 107463946
6-methyl-N-(1-methyl-3-propan-2-ylpyrazol-4-yl)pyridin-2-amine
CID 114263278
N-(3-ethyl-1-methylpyrazol-4-yl)-3-propan-2-yl-1,2,4-thiadiazol-5-amine
CID 103908134
N-(2,2-dimethylpropyl)-3-ethyl-1-methylpyrazol-4-amine
CID 115898031
6-bromo-N-[(3-ethyl-1-methylpyrazol-4-yl)methyl]-2-methylpyridin-3-amine
CID 104599955

Frequently Asked Questions

What is the IUPAC name of 6-bromo-N-(3-ethyl-1-methylpyrazol-4-yl)pyridin-2-amine?
The IUPAC name of 6-bromo-N-(3-ethyl-1-methylpyrazol-4-yl)pyridin-2-amine (CID 107464291) is 6-bromo-N-(3-ethyl-1-methylpyrazol-4-yl)pyridin-2-amine.
What is the SMILES notation for 6-bromo-N-(3-ethyl-1-methylpyrazol-4-yl)pyridin-2-amine?
The canonical SMILES for 6-bromo-N-(3-ethyl-1-methylpyrazol-4-yl)pyridin-2-amine is CCc1nn(C)cc1Nc1cccc(Br)n1.
What is the InChIKey of 6-bromo-N-(3-ethyl-1-methylpyrazol-4-yl)pyridin-2-amine?
The InChIKey is IWNUXLVZUVTJDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13BrN4/c1-3-8-9(7-16(2)15-8)13-11-6-4-5-10(12)14-11/h4-7H,3H2,1-2H3,(H,13,14).
What are the key properties of 6-bromo-N-(3-ethyl-1-methylpyrazol-4-yl)pyridin-2-amine?
6-bromo-N-(3-ethyl-1-methylpyrazol-4-yl)pyridin-2-amine has a molecular weight of 281.16 g/mol, XLogP of 2.88, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-N-(3-ethyl-1-methylpyrazol-4-yl)pyridin-2-amine is sourced from PubChem (CID 107464291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).