5-bromo-3-(5-cyclopropyl-1H-pyrazol-3-yl)pyridin-2-amine

C11H11BrN4 — CID 141469156

IUPAC5-bromo-3-(5-cyclopropyl-1H-pyrazol-3-yl)pyridin-2-amine
SMILESNc1ncc(Br)cc1-c1cc(C2CC2)[nH]n1
InChIInChI=1S/C11H11BrN4/c12-7-3-8(11(13)14-5-7)10-4-9(15-16-10)6-1-2-6/h3-6H,1-2H2,(H2,13,14)(H,15,16)
InChIKeyZOGMFKLNKWPNLP-UHFFFAOYSA-N
MW279.14 g/mol
LogP2.69
Rot. Bonds2

About 5-bromo-3-(5-cyclopropyl-1H-pyrazol-3-yl)pyridin-2-amine

5-bromo-3-(5-cyclopropyl-1H-pyrazol-3-yl)pyridin-2-amine (PubChem CID 141469156) has the molecular formula C11H11BrN4 and a molecular weight of 279.14 g/mol. Its IUPAC name is 5-bromo-3-(5-cyclopropyl-1H-pyrazol-3-yl)pyridin-2-amine.

Molecular Properties

Compound Name5-bromo-3-(5-cyclopropyl-1H-pyrazol-3-yl)pyridin-2-amine
PubChem CID141469156
Molecular FormulaC11H11BrN4
Molecular Weight279.14 g/mol
Exact Mass278.02
IUPAC Name5-bromo-3-(5-cyclopropyl-1H-pyrazol-3-yl)pyridin-2-amine
SMILESNc1ncc(Br)cc1-c1cc(C2CC2)[nH]n1
InChIInChI=1S/C11H11BrN4/c12-7-3-8(11(13)14-5-7)10-4-9(15-16-10)6-1-2-6/h3-6H,1-2H2,(H2,13,14)(H,15,16)
InChIKeyZOGMFKLNKWPNLP-UHFFFAOYSA-N
XLogP2.69
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.14
LogP ≤ 52.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-bromo-3-(5-cyclopropyl-1H-pyrazol-3-yl)pyridin-2-amine?
The IUPAC name of 5-bromo-3-(5-cyclopropyl-1H-pyrazol-3-yl)pyridin-2-amine (CID 141469156) is 5-bromo-3-(5-cyclopropyl-1H-pyrazol-3-yl)pyridin-2-amine.
What is the SMILES notation for 5-bromo-3-(5-cyclopropyl-1H-pyrazol-3-yl)pyridin-2-amine?
The canonical SMILES for 5-bromo-3-(5-cyclopropyl-1H-pyrazol-3-yl)pyridin-2-amine is Nc1ncc(Br)cc1-c1cc(C2CC2)[nH]n1.
What is the InChIKey of 5-bromo-3-(5-cyclopropyl-1H-pyrazol-3-yl)pyridin-2-amine?
The InChIKey is ZOGMFKLNKWPNLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11BrN4/c12-7-3-8(11(13)14-5-7)10-4-9(15-16-10)6-1-2-6/h3-6H,1-2H2,(H2,13,14)(H,15,16).
What are the key properties of 5-bromo-3-(5-cyclopropyl-1H-pyrazol-3-yl)pyridin-2-amine?
5-bromo-3-(5-cyclopropyl-1H-pyrazol-3-yl)pyridin-2-amine has a molecular weight of 279.14 g/mol, XLogP of 2.69, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-3-(5-cyclopropyl-1H-pyrazol-3-yl)pyridin-2-amine is sourced from PubChem (CID 141469156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).