N-(2,5-dimethyloxolan-3-yl)-3-fluoropyrazin-2-amine

C10H14FN3O — CID 164648150

IUPACN-(2,5-dimethyloxolan-3-yl)-3-fluoropyrazin-2-amine
SMILESCC1CC(Nc2nccnc2F)C(C)O1
InChIInChI=1S/C10H14FN3O/c1-6-5-8(7(2)15-6)14-10-9(11)12-3-4-13-10/h3-4,6-8H,5H2,1-2H3,(H,13,14)
InChIKeyINLGATOGEKKTHF-UHFFFAOYSA-N
MW211.24 g/mol
LogP1.59
Rot. Bonds2

About N-(2,5-dimethyloxolan-3-yl)-3-fluoropyrazin-2-amine

N-(2,5-dimethyloxolan-3-yl)-3-fluoropyrazin-2-amine (PubChem CID 164648150) has the molecular formula C10H14FN3O and a molecular weight of 211.24 g/mol. Its IUPAC name is N-(2,5-dimethyloxolan-3-yl)-3-fluoropyrazin-2-amine.

Molecular Properties

Compound NameN-(2,5-dimethyloxolan-3-yl)-3-fluoropyrazin-2-amine
PubChem CID164648150
Molecular FormulaC10H14FN3O
Molecular Weight211.24 g/mol
Exact Mass211.11
IUPAC NameN-(2,5-dimethyloxolan-3-yl)-3-fluoropyrazin-2-amine
SMILESCC1CC(Nc2nccnc2F)C(C)O1
InChIInChI=1S/C10H14FN3O/c1-6-5-8(7(2)15-6)14-10-9(11)12-3-4-13-10/h3-4,6-8H,5H2,1-2H3,(H,13,14)
InChIKeyINLGATOGEKKTHF-UHFFFAOYSA-N
XLogP1.59
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.24
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2,5-dimethyloxolan-3-yl)-3-fluoropyrazin-2-amine?
The IUPAC name of N-(2,5-dimethyloxolan-3-yl)-3-fluoropyrazin-2-amine (CID 164648150) is N-(2,5-dimethyloxolan-3-yl)-3-fluoropyrazin-2-amine.
What is the SMILES notation for N-(2,5-dimethyloxolan-3-yl)-3-fluoropyrazin-2-amine?
The canonical SMILES for N-(2,5-dimethyloxolan-3-yl)-3-fluoropyrazin-2-amine is CC1CC(Nc2nccnc2F)C(C)O1.
What is the InChIKey of N-(2,5-dimethyloxolan-3-yl)-3-fluoropyrazin-2-amine?
The InChIKey is INLGATOGEKKTHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14FN3O/c1-6-5-8(7(2)15-6)14-10-9(11)12-3-4-13-10/h3-4,6-8H,5H2,1-2H3,(H,13,14).
What are the key properties of N-(2,5-dimethyloxolan-3-yl)-3-fluoropyrazin-2-amine?
N-(2,5-dimethyloxolan-3-yl)-3-fluoropyrazin-2-amine has a molecular weight of 211.24 g/mol, XLogP of 1.59, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dimethyloxolan-3-yl)-3-fluoropyrazin-2-amine is sourced from PubChem (CID 164648150), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).