5-bromo-4-cyclobutyloxy-3-fluoropyridin-2-amine

C9H10BrFN2O — CID 155437209

IUPAC5-bromo-4-cyclobutyloxy-3-fluoropyridin-2-amine
SMILESNc1ncc(Br)c(OC2CCC2)c1F
InChIInChI=1S/C9H10BrFN2O/c10-6-4-13-9(12)7(11)8(6)14-5-2-1-3-5/h4-5H,1-3H2,(H2,12,13)
InChIKeyRUDJZXKGJUNQRC-UHFFFAOYSA-N
MW261.09 g/mol
LogP2.50
Rot. Bonds2

About 5-bromo-4-cyclobutyloxy-3-fluoropyridin-2-amine

5-bromo-4-cyclobutyloxy-3-fluoropyridin-2-amine (PubChem CID 155437209) has the molecular formula C9H10BrFN2O and a molecular weight of 261.09 g/mol. Its IUPAC name is 5-bromo-4-cyclobutyloxy-3-fluoropyridin-2-amine.

Molecular Properties

Compound Name5-bromo-4-cyclobutyloxy-3-fluoropyridin-2-amine
PubChem CID155437209
Molecular FormulaC9H10BrFN2O
Molecular Weight261.09 g/mol
Exact Mass260.00
IUPAC Name5-bromo-4-cyclobutyloxy-3-fluoropyridin-2-amine
SMILESNc1ncc(Br)c(OC2CCC2)c1F
InChIInChI=1S/C9H10BrFN2O/c10-6-4-13-9(12)7(11)8(6)14-5-2-1-3-5/h4-5H,1-3H2,(H2,12,13)
InChIKeyRUDJZXKGJUNQRC-UHFFFAOYSA-N
XLogP2.50
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.09
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-bromo-4-cyclobutyloxy-3-fluoropyridin-2-amine?
The IUPAC name of 5-bromo-4-cyclobutyloxy-3-fluoropyridin-2-amine (CID 155437209) is 5-bromo-4-cyclobutyloxy-3-fluoropyridin-2-amine.
What is the SMILES notation for 5-bromo-4-cyclobutyloxy-3-fluoropyridin-2-amine?
The canonical SMILES for 5-bromo-4-cyclobutyloxy-3-fluoropyridin-2-amine is Nc1ncc(Br)c(OC2CCC2)c1F.
What is the InChIKey of 5-bromo-4-cyclobutyloxy-3-fluoropyridin-2-amine?
The InChIKey is RUDJZXKGJUNQRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10BrFN2O/c10-6-4-13-9(12)7(11)8(6)14-5-2-1-3-5/h4-5H,1-3H2,(H2,12,13).
What are the key properties of 5-bromo-4-cyclobutyloxy-3-fluoropyridin-2-amine?
5-bromo-4-cyclobutyloxy-3-fluoropyridin-2-amine has a molecular weight of 261.09 g/mol, XLogP of 2.50, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-4-cyclobutyloxy-3-fluoropyridin-2-amine is sourced from PubChem (CID 155437209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).