N-(azetidin-3-yl)-3,5-difluoropyridin-2-amine

C8H9F2N3 — CID 112676196

IUPACN-(azetidin-3-yl)-3,5-difluoropyridin-2-amine
SMILESFc1cnc(NC2CNC2)c(F)c1
InChIInChI=1S/C8H9F2N3/c9-5-1-7(10)8(12-2-5)13-6-3-11-4-6/h1-2,6,11H,3-4H2,(H,12,13)
InChIKeyVZJYVLHNTPZFMM-UHFFFAOYSA-N
MW185.18 g/mol
LogP0.74
Rot. Bonds2

About N-(azetidin-3-yl)-3,5-difluoropyridin-2-amine

N-(azetidin-3-yl)-3,5-difluoropyridin-2-amine (PubChem CID 112676196) has the molecular formula C8H9F2N3 and a molecular weight of 185.18 g/mol. Its IUPAC name is N-(azetidin-3-yl)-3,5-difluoropyridin-2-amine.

Molecular Properties

Compound NameN-(azetidin-3-yl)-3,5-difluoropyridin-2-amine
PubChem CID112676196
Molecular FormulaC8H9F2N3
Molecular Weight185.18 g/mol
Exact Mass185.08
IUPAC NameN-(azetidin-3-yl)-3,5-difluoropyridin-2-amine
SMILESFc1cnc(NC2CNC2)c(F)c1
InChIInChI=1S/C8H9F2N3/c9-5-1-7(10)8(12-2-5)13-6-3-11-4-6/h1-2,6,11H,3-4H2,(H,12,13)
InChIKeyVZJYVLHNTPZFMM-UHFFFAOYSA-N
XLogP0.74
TPSA36.95 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.18
LogP ≤ 50.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(azetidin-3-yl)-3,5-difluoropyridin-2-amine?
The IUPAC name of N-(azetidin-3-yl)-3,5-difluoropyridin-2-amine (CID 112676196) is N-(azetidin-3-yl)-3,5-difluoropyridin-2-amine.
What is the SMILES notation for N-(azetidin-3-yl)-3,5-difluoropyridin-2-amine?
The canonical SMILES for N-(azetidin-3-yl)-3,5-difluoropyridin-2-amine is Fc1cnc(NC2CNC2)c(F)c1.
What is the InChIKey of N-(azetidin-3-yl)-3,5-difluoropyridin-2-amine?
The InChIKey is VZJYVLHNTPZFMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9F2N3/c9-5-1-7(10)8(12-2-5)13-6-3-11-4-6/h1-2,6,11H,3-4H2,(H,12,13).
What are the key properties of N-(azetidin-3-yl)-3,5-difluoropyridin-2-amine?
N-(azetidin-3-yl)-3,5-difluoropyridin-2-amine has a molecular weight of 185.18 g/mol, XLogP of 0.74, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(azetidin-3-yl)-3,5-difluoropyridin-2-amine is sourced from PubChem (CID 112676196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).