2-(5-propan-2-ylpyrazin-2-yl)propan-2-ol

C10H16N2O — CID 11535672

IUPAC2-(5-propan-2-ylpyrazin-2-yl)propan-2-ol
SMILESCC(C)c1cnc(C(C)(C)O)cn1
InChIInChI=1S/C10H16N2O/c1-7(2)8-5-12-9(6-11-8)10(3,4)13/h5-7,13H,1-4H3
InChIKeySEQOBFCOIPROTR-UHFFFAOYSA-N
MW180.25 g/mol
LogP1.83
Rot. Bonds2

About 2-(5-propan-2-ylpyrazin-2-yl)propan-2-ol

2-(5-propan-2-ylpyrazin-2-yl)propan-2-ol (PubChem CID 11535672) has the molecular formula C10H16N2O and a molecular weight of 180.25 g/mol. Its IUPAC name is 2-(5-propan-2-ylpyrazin-2-yl)propan-2-ol.

Molecular Properties

Compound Name2-(5-propan-2-ylpyrazin-2-yl)propan-2-ol
PubChem CID11535672
Molecular FormulaC10H16N2O
Molecular Weight180.25 g/mol
Exact Mass180.13
IUPAC Name2-(5-propan-2-ylpyrazin-2-yl)propan-2-ol
SMILESCC(C)c1cnc(C(C)(C)O)cn1
InChIInChI=1S/C10H16N2O/c1-7(2)8-5-12-9(6-11-8)10(3,4)13/h5-7,13H,1-4H3
InChIKeySEQOBFCOIPROTR-UHFFFAOYSA-N
XLogP1.83
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.25
LogP ≤ 51.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(5-propan-2-ylpyrazin-2-yl)propan-2-ol?
The IUPAC name of 2-(5-propan-2-ylpyrazin-2-yl)propan-2-ol (CID 11535672) is 2-(5-propan-2-ylpyrazin-2-yl)propan-2-ol.
What is the SMILES notation for 2-(5-propan-2-ylpyrazin-2-yl)propan-2-ol?
The canonical SMILES for 2-(5-propan-2-ylpyrazin-2-yl)propan-2-ol is CC(C)c1cnc(C(C)(C)O)cn1.
What is the InChIKey of 2-(5-propan-2-ylpyrazin-2-yl)propan-2-ol?
The InChIKey is SEQOBFCOIPROTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O/c1-7(2)8-5-12-9(6-11-8)10(3,4)13/h5-7,13H,1-4H3.
What are the key properties of 2-(5-propan-2-ylpyrazin-2-yl)propan-2-ol?
2-(5-propan-2-ylpyrazin-2-yl)propan-2-ol has a molecular weight of 180.25 g/mol, XLogP of 1.83, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-propan-2-ylpyrazin-2-yl)propan-2-ol is sourced from PubChem (CID 11535672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).