6-(4-bromopyrazol-1-yl)-5-methylpyridin-3-amine

C9H9BrN4 — CID 62476407

IUPAC6-(4-bromopyrazol-1-yl)-5-methylpyridin-3-amine
SMILESCc1cc(N)cnc1-n1cc(Br)cn1
InChIInChI=1S/C9H9BrN4/c1-6-2-8(11)4-12-9(6)14-5-7(10)3-13-14/h2-5H,11H2,1H3
InChIKeyGVDVLQRPMOMSMH-UHFFFAOYSA-N
MW253.10 g/mol
LogP1.92
Rot. Bonds1

About 6-(4-bromopyrazol-1-yl)-5-methylpyridin-3-amine

6-(4-bromopyrazol-1-yl)-5-methylpyridin-3-amine (PubChem CID 62476407) has the molecular formula C9H9BrN4 and a molecular weight of 253.10 g/mol. Its IUPAC name is 6-(4-bromopyrazol-1-yl)-5-methylpyridin-3-amine.

Molecular Properties

Compound Name6-(4-bromopyrazol-1-yl)-5-methylpyridin-3-amine
PubChem CID62476407
Molecular FormulaC9H9BrN4
Molecular Weight253.10 g/mol
Exact Mass252.00
IUPAC Name6-(4-bromopyrazol-1-yl)-5-methylpyridin-3-amine
SMILESCc1cc(N)cnc1-n1cc(Br)cn1
InChIInChI=1S/C9H9BrN4/c1-6-2-8(11)4-12-9(6)14-5-7(10)3-13-14/h2-5H,11H2,1H3
InChIKeyGVDVLQRPMOMSMH-UHFFFAOYSA-N
XLogP1.92
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.10
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-(4-bromopyrazol-1-yl)-5-methylpyridin-3-amine?
The IUPAC name of 6-(4-bromopyrazol-1-yl)-5-methylpyridin-3-amine (CID 62476407) is 6-(4-bromopyrazol-1-yl)-5-methylpyridin-3-amine.
What is the SMILES notation for 6-(4-bromopyrazol-1-yl)-5-methylpyridin-3-amine?
The canonical SMILES for 6-(4-bromopyrazol-1-yl)-5-methylpyridin-3-amine is Cc1cc(N)cnc1-n1cc(Br)cn1.
What is the InChIKey of 6-(4-bromopyrazol-1-yl)-5-methylpyridin-3-amine?
The InChIKey is GVDVLQRPMOMSMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9BrN4/c1-6-2-8(11)4-12-9(6)14-5-7(10)3-13-14/h2-5H,11H2,1H3.
What are the key properties of 6-(4-bromopyrazol-1-yl)-5-methylpyridin-3-amine?
6-(4-bromopyrazol-1-yl)-5-methylpyridin-3-amine has a molecular weight of 253.10 g/mol, XLogP of 1.92, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-bromopyrazol-1-yl)-5-methylpyridin-3-amine is sourced from PubChem (CID 62476407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).