2-(cyclopropylmethoxy)-5-propan-2-ylpyrazine

C11H16N2O — CID 58448486

IUPAC2-(cyclopropylmethoxy)-5-propan-2-ylpyrazine
SMILESCC(C)c1cnc(OCC2CC2)cn1
InChIInChI=1S/C11H16N2O/c1-8(2)10-5-13-11(6-12-10)14-7-9-3-4-9/h5-6,8-9H,3-4,7H2,1-2H3
InChIKeyMRBHMBKQFRZIKR-UHFFFAOYSA-N
MW192.26 g/mol
LogP2.39
Rot. Bonds4

About 2-(cyclopropylmethoxy)-5-propan-2-ylpyrazine

2-(cyclopropylmethoxy)-5-propan-2-ylpyrazine (PubChem CID 58448486) has the molecular formula C11H16N2O and a molecular weight of 192.26 g/mol. Its IUPAC name is 2-(cyclopropylmethoxy)-5-propan-2-ylpyrazine.

Molecular Properties

Compound Name2-(cyclopropylmethoxy)-5-propan-2-ylpyrazine
PubChem CID58448486
Molecular FormulaC11H16N2O
Molecular Weight192.26 g/mol
Exact Mass192.13
IUPAC Name2-(cyclopropylmethoxy)-5-propan-2-ylpyrazine
SMILESCC(C)c1cnc(OCC2CC2)cn1
InChIInChI=1S/C11H16N2O/c1-8(2)10-5-13-11(6-12-10)14-7-9-3-4-9/h5-6,8-9H,3-4,7H2,1-2H3
InChIKeyMRBHMBKQFRZIKR-UHFFFAOYSA-N
XLogP2.39
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.26
LogP ≤ 52.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylmethoxy)-5-propan-2-ylpyrazine?
The IUPAC name of 2-(cyclopropylmethoxy)-5-propan-2-ylpyrazine (CID 58448486) is 2-(cyclopropylmethoxy)-5-propan-2-ylpyrazine.
What is the SMILES notation for 2-(cyclopropylmethoxy)-5-propan-2-ylpyrazine?
The canonical SMILES for 2-(cyclopropylmethoxy)-5-propan-2-ylpyrazine is CC(C)c1cnc(OCC2CC2)cn1.
What is the InChIKey of 2-(cyclopropylmethoxy)-5-propan-2-ylpyrazine?
The InChIKey is MRBHMBKQFRZIKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O/c1-8(2)10-5-13-11(6-12-10)14-7-9-3-4-9/h5-6,8-9H,3-4,7H2,1-2H3.
What are the key properties of 2-(cyclopropylmethoxy)-5-propan-2-ylpyrazine?
2-(cyclopropylmethoxy)-5-propan-2-ylpyrazine has a molecular weight of 192.26 g/mol, XLogP of 2.39, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylmethoxy)-5-propan-2-ylpyrazine is sourced from PubChem (CID 58448486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).