2-[1-[2-[(2R)-oxan-2-yl]oxyethyl]imidazol-2-yl]pyrazine

C14H18N4O2 — CID 100715331

IUPAC2-[1-[2-[(2R)-oxan-2-yl]oxyethyl]imidazol-2-yl]pyrazine
SMILESc1cnc(-c2nccn2CCO[C@@H]2CCCCO2)cn1
InChIInChI=1S/C14H18N4O2/c1-2-9-19-13(3-1)20-10-8-18-7-6-17-14(18)12-11-15-4-5-16-12/h4-7,11,13H,1-3,8-10H2/t13-/m1/s1
InChIKeyFKXRYFWQQWQFGS-CYBMUJFWSA-N
MW274.32 g/mol
LogP1.88
Rot. Bonds5

About 2-[1-[2-[(2R)-oxan-2-yl]oxyethyl]imidazol-2-yl]pyrazine

2-[1-[2-[(2R)-oxan-2-yl]oxyethyl]imidazol-2-yl]pyrazine (PubChem CID 100715331) has the molecular formula C14H18N4O2 and a molecular weight of 274.32 g/mol. Its IUPAC name is 2-[1-[2-[(2R)-oxan-2-yl]oxyethyl]imidazol-2-yl]pyrazine.

Molecular Properties

Compound Name2-[1-[2-[(2R)-oxan-2-yl]oxyethyl]imidazol-2-yl]pyrazine
PubChem CID100715331
Molecular FormulaC14H18N4O2
Molecular Weight274.32 g/mol
Exact Mass274.14
IUPAC Name2-[1-[2-[(2R)-oxan-2-yl]oxyethyl]imidazol-2-yl]pyrazine
SMILESc1cnc(-c2nccn2CCO[C@@H]2CCCCO2)cn1
InChIInChI=1S/C14H18N4O2/c1-2-9-19-13(3-1)20-10-8-18-7-6-17-14(18)12-11-15-4-5-16-12/h4-7,11,13H,1-3,8-10H2/t13-/m1/s1
InChIKeyFKXRYFWQQWQFGS-CYBMUJFWSA-N
XLogP1.88
TPSA62.06 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.32
LogP ≤ 51.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-[1-[2-[(2R)-oxan-2-yl]oxyethyl]imidazol-2-yl]pyrazine?
The IUPAC name of 2-[1-[2-[(2R)-oxan-2-yl]oxyethyl]imidazol-2-yl]pyrazine (CID 100715331) is 2-[1-[2-[(2R)-oxan-2-yl]oxyethyl]imidazol-2-yl]pyrazine.
What is the SMILES notation for 2-[1-[2-[(2R)-oxan-2-yl]oxyethyl]imidazol-2-yl]pyrazine?
The canonical SMILES for 2-[1-[2-[(2R)-oxan-2-yl]oxyethyl]imidazol-2-yl]pyrazine is c1cnc(-c2nccn2CCO[C@@H]2CCCCO2)cn1.
What is the InChIKey of 2-[1-[2-[(2R)-oxan-2-yl]oxyethyl]imidazol-2-yl]pyrazine?
The InChIKey is FKXRYFWQQWQFGS-CYBMUJFWSA-N. The full InChI is InChI=1S/C14H18N4O2/c1-2-9-19-13(3-1)20-10-8-18-7-6-17-14(18)12-11-15-4-5-16-12/h4-7,11,13H,1-3,8-10H2/t13-/m1/s1.
What are the key properties of 2-[1-[2-[(2R)-oxan-2-yl]oxyethyl]imidazol-2-yl]pyrazine?
2-[1-[2-[(2R)-oxan-2-yl]oxyethyl]imidazol-2-yl]pyrazine has a molecular weight of 274.32 g/mol, XLogP of 1.88, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[2-[(2R)-oxan-2-yl]oxyethyl]imidazol-2-yl]pyrazine is sourced from PubChem (CID 100715331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).