5-bromo-3-chloro-N-(1-methylpyrazol-4-yl)pyridin-2-amine

C9H8BrClN4 — CID 103582386

IUPAC5-bromo-3-chloro-N-(1-methylpyrazol-4-yl)pyridin-2-amine
SMILESCn1cc(Nc2ncc(Br)cc2Cl)cn1
InChIInChI=1S/C9H8BrClN4/c1-15-5-7(4-13-15)14-9-8(11)2-6(10)3-12-9/h2-5H,1H3,(H,12,14)
InChIKeyVURWRAXHZKGSPM-UHFFFAOYSA-N
MW287.55 g/mol
LogP2.97
Rot. Bonds2

About 5-bromo-3-chloro-N-(1-methylpyrazol-4-yl)pyridin-2-amine

5-bromo-3-chloro-N-(1-methylpyrazol-4-yl)pyridin-2-amine (PubChem CID 103582386) has the molecular formula C9H8BrClN4 and a molecular weight of 287.55 g/mol. Its IUPAC name is 5-bromo-3-chloro-N-(1-methylpyrazol-4-yl)pyridin-2-amine.

Molecular Properties

Compound Name5-bromo-3-chloro-N-(1-methylpyrazol-4-yl)pyridin-2-amine
PubChem CID103582386
Molecular FormulaC9H8BrClN4
Molecular Weight287.55 g/mol
Exact Mass285.96
IUPAC Name5-bromo-3-chloro-N-(1-methylpyrazol-4-yl)pyridin-2-amine
SMILESCn1cc(Nc2ncc(Br)cc2Cl)cn1
InChIInChI=1S/C9H8BrClN4/c1-15-5-7(4-13-15)14-9-8(11)2-6(10)3-12-9/h2-5H,1H3,(H,12,14)
InChIKeyVURWRAXHZKGSPM-UHFFFAOYSA-N
XLogP2.97
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.55
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-bromo-3-chloro-N-(3,5-dimethylphenyl)pyridin-2-amine
CID 103583097
5-chloro-N-(1-methylpyrazol-4-yl)pyrimidin-4-amine
CID 105369180
5-bromo-6-[(1-methylpyrazol-4-yl)amino]pyridine-3-carboxylic acid
CID 167950874
5-[(5-bromo-3-chloro-2-pyridinyl)amino]-2-methylisoindole-1,3-dione
CID 103583037
5-bromo-N-(4-bromo-2,6-dimethylphenyl)-3-chloropyridin-2-amine
CID 103583373
2-chloro-5-methyl-N-(1-methylpyrazol-4-yl)pyrimidin-4-amine
CID 79779087
5-chloro-6-hydrazinyl-N-(1-methylpyrazol-4-yl)pyridine-3-carboxamide
CID 62241771
5-bromo-3-chloro-N-(3-fluorophenyl)pyridin-2-amine
CID 103583086
5-bromo-3-chloro-N-(1-methylpiperidin-4-yl)pyridin-2-amine
CID 103579990
5-bromo-3-chloro-N-[3-(chloromethyl)phenyl]pyridin-2-amine
CID 103584097
6-bromo-N-(1-methylpyrazol-4-yl)quinazolin-2-amine
CID 155777536
2-chloro-N-(1-methylpyrazol-4-yl)-5-(trifluoromethyl)pyrimidin-4-amine
CID 156636551

Frequently Asked Questions

What is the IUPAC name of 5-bromo-3-chloro-N-(1-methylpyrazol-4-yl)pyridin-2-amine?
The IUPAC name of 5-bromo-3-chloro-N-(1-methylpyrazol-4-yl)pyridin-2-amine (CID 103582386) is 5-bromo-3-chloro-N-(1-methylpyrazol-4-yl)pyridin-2-amine.
What is the SMILES notation for 5-bromo-3-chloro-N-(1-methylpyrazol-4-yl)pyridin-2-amine?
The canonical SMILES for 5-bromo-3-chloro-N-(1-methylpyrazol-4-yl)pyridin-2-amine is Cn1cc(Nc2ncc(Br)cc2Cl)cn1.
What is the InChIKey of 5-bromo-3-chloro-N-(1-methylpyrazol-4-yl)pyridin-2-amine?
The InChIKey is VURWRAXHZKGSPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8BrClN4/c1-15-5-7(4-13-15)14-9-8(11)2-6(10)3-12-9/h2-5H,1H3,(H,12,14).
What are the key properties of 5-bromo-3-chloro-N-(1-methylpyrazol-4-yl)pyridin-2-amine?
5-bromo-3-chloro-N-(1-methylpyrazol-4-yl)pyridin-2-amine has a molecular weight of 287.55 g/mol, XLogP of 2.97, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-3-chloro-N-(1-methylpyrazol-4-yl)pyridin-2-amine is sourced from PubChem (CID 103582386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).