5-bromo-4-methyl-6-(4-phenylpyrazol-1-yl)pyridin-3-amine

C15H13BrN4 — CID 104507188

IUPAC5-bromo-4-methyl-6-(4-phenylpyrazol-1-yl)pyridin-3-amine
SMILESCc1c(N)cnc(-n2cc(-c3ccccc3)cn2)c1Br
InChIInChI=1S/C15H13BrN4/c1-10-13(17)8-18-15(14(10)16)20-9-12(7-19-20)11-5-3-2-4-6-11/h2-9H,17H2,1H3
InChIKeyUMDYPOOAHPCPKA-UHFFFAOYSA-N
MW329.20 g/mol
LogP3.59
Rot. Bonds2

About 5-bromo-4-methyl-6-(4-phenylpyrazol-1-yl)pyridin-3-amine

5-bromo-4-methyl-6-(4-phenylpyrazol-1-yl)pyridin-3-amine (PubChem CID 104507188) has the molecular formula C15H13BrN4 and a molecular weight of 329.20 g/mol. Its IUPAC name is 5-bromo-4-methyl-6-(4-phenylpyrazol-1-yl)pyridin-3-amine.

Molecular Properties

Compound Name5-bromo-4-methyl-6-(4-phenylpyrazol-1-yl)pyridin-3-amine
PubChem CID104507188
Molecular FormulaC15H13BrN4
Molecular Weight329.20 g/mol
Exact Mass328.03
IUPAC Name5-bromo-4-methyl-6-(4-phenylpyrazol-1-yl)pyridin-3-amine
SMILESCc1c(N)cnc(-n2cc(-c3ccccc3)cn2)c1Br
InChIInChI=1S/C15H13BrN4/c1-10-13(17)8-18-15(14(10)16)20-9-12(7-19-20)11-5-3-2-4-6-11/h2-9H,17H2,1H3
InChIKeyUMDYPOOAHPCPKA-UHFFFAOYSA-N
XLogP3.59
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.20
LogP ≤ 53.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-methyl-6-(4-phenylpyrazol-1-yl)pyrimidin-4-amine
CID 80857400
4-methyl-6-(4-phenylpyrazol-1-yl)pyridin-3-amine
CID 79176732
5-bromo-6-(4-phenylpyrazol-1-yl)pyridin-3-amine
CID 79534571
2-[1-(3-bromo-5-methyl-2-pyridinyl)pyrazol-4-yl]aniline
CID 105367559
[5-methyl-6-(4-phenylpyrazol-1-yl)pyrimidin-4-yl]hydrazine
CID 80901558
5-bromo-3-(chloromethyl)-2-(4-phenylpyrazol-1-yl)pyridine
CID 62772214
2-chloro-5-methyl-4-(4-phenylpyrazol-1-yl)pyrimidine
CID 79073316
6-(4-phenylpyrazol-1-yl)-5-propan-2-ylpyrimidin-4-amine
CID 80841993
5-bromo-6-chloro-2-(4-phenylpyrazol-1-yl)pyrimidin-4-amine
CID 90303712
N-ethyl-5-methyl-6-(4-phenylpyrazol-1-yl)pyrimidin-4-amine
CID 80840306
5-(4-phenylpyrazol-1-yl)pyrazin-2-amine
CID 80663482
5-fluoro-4-methyl-2-(4-phenylpyrazol-1-yl)aniline
CID 103590874

Frequently Asked Questions

What is the IUPAC name of 5-bromo-4-methyl-6-(4-phenylpyrazol-1-yl)pyridin-3-amine?
The IUPAC name of 5-bromo-4-methyl-6-(4-phenylpyrazol-1-yl)pyridin-3-amine (CID 104507188) is 5-bromo-4-methyl-6-(4-phenylpyrazol-1-yl)pyridin-3-amine.
What is the SMILES notation for 5-bromo-4-methyl-6-(4-phenylpyrazol-1-yl)pyridin-3-amine?
The canonical SMILES for 5-bromo-4-methyl-6-(4-phenylpyrazol-1-yl)pyridin-3-amine is Cc1c(N)cnc(-n2cc(-c3ccccc3)cn2)c1Br.
What is the InChIKey of 5-bromo-4-methyl-6-(4-phenylpyrazol-1-yl)pyridin-3-amine?
The InChIKey is UMDYPOOAHPCPKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13BrN4/c1-10-13(17)8-18-15(14(10)16)20-9-12(7-19-20)11-5-3-2-4-6-11/h2-9H,17H2,1H3.
What are the key properties of 5-bromo-4-methyl-6-(4-phenylpyrazol-1-yl)pyridin-3-amine?
5-bromo-4-methyl-6-(4-phenylpyrazol-1-yl)pyridin-3-amine has a molecular weight of 329.20 g/mol, XLogP of 3.59, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-4-methyl-6-(4-phenylpyrazol-1-yl)pyridin-3-amine is sourced from PubChem (CID 104507188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).