5-bromo-N-(1,5-dimethylpyrazol-3-yl)pyridin-3-amine

C10H11BrN4 — CID 130496929

IUPAC5-bromo-N-(1,5-dimethylpyrazol-3-yl)pyridin-3-amine
SMILESCc1cc(Nc2cncc(Br)c2)nn1C
InChIInChI=1S/C10H11BrN4/c1-7-3-10(14-15(7)2)13-9-4-8(11)5-12-6-9/h3-6H,1-2H3,(H,13,14)
InChIKeyZZUPLKKMYOYESO-UHFFFAOYSA-N
MW267.13 g/mol
LogP2.63
Rot. Bonds2

About 5-bromo-N-(1,5-dimethylpyrazol-3-yl)pyridin-3-amine

5-bromo-N-(1,5-dimethylpyrazol-3-yl)pyridin-3-amine (PubChem CID 130496929) has the molecular formula C10H11BrN4 and a molecular weight of 267.13 g/mol. Its IUPAC name is 5-bromo-N-(1,5-dimethylpyrazol-3-yl)pyridin-3-amine.

Molecular Properties

Compound Name5-bromo-N-(1,5-dimethylpyrazol-3-yl)pyridin-3-amine
PubChem CID130496929
Molecular FormulaC10H11BrN4
Molecular Weight267.13 g/mol
Exact Mass266.02
IUPAC Name5-bromo-N-(1,5-dimethylpyrazol-3-yl)pyridin-3-amine
SMILESCc1cc(Nc2cncc(Br)c2)nn1C
InChIInChI=1S/C10H11BrN4/c1-7-3-10(14-15(7)2)13-9-4-8(11)5-12-6-9/h3-6H,1-2H3,(H,13,14)
InChIKeyZZUPLKKMYOYESO-UHFFFAOYSA-N
XLogP2.63
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.13
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-bromo-N-(1,5-dimethylpyrazol-3-yl)pyridin-3-amine?
The IUPAC name of 5-bromo-N-(1,5-dimethylpyrazol-3-yl)pyridin-3-amine (CID 130496929) is 5-bromo-N-(1,5-dimethylpyrazol-3-yl)pyridin-3-amine.
What is the SMILES notation for 5-bromo-N-(1,5-dimethylpyrazol-3-yl)pyridin-3-amine?
The canonical SMILES for 5-bromo-N-(1,5-dimethylpyrazol-3-yl)pyridin-3-amine is Cc1cc(Nc2cncc(Br)c2)nn1C.
What is the InChIKey of 5-bromo-N-(1,5-dimethylpyrazol-3-yl)pyridin-3-amine?
The InChIKey is ZZUPLKKMYOYESO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11BrN4/c1-7-3-10(14-15(7)2)13-9-4-8(11)5-12-6-9/h3-6H,1-2H3,(H,13,14).
What are the key properties of 5-bromo-N-(1,5-dimethylpyrazol-3-yl)pyridin-3-amine?
5-bromo-N-(1,5-dimethylpyrazol-3-yl)pyridin-3-amine has a molecular weight of 267.13 g/mol, XLogP of 2.63, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N-(1,5-dimethylpyrazol-3-yl)pyridin-3-amine is sourced from PubChem (CID 130496929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).