[(2R)-6-methoxy-2-propan-2-yl-2,5-dihydropyrazin-3-yl]methanol

C9H16N2O2 — CID 58356982

IUPAC[(2R)-6-methoxy-2-propan-2-yl-2,5-dihydropyrazin-3-yl]methanol
SMILESCOC1=N[C@H](C(C)C)C(CO)=NC1
InChIInChI=1S/C9H16N2O2/c1-6(2)9-7(5-12)10-4-8(11-9)13-3/h6,9,12H,4-5H2,1-3H3/t9-/m1/s1
InChIKeyGPCFCDPCFQISTH-SECBINFHSA-N
MW184.24 g/mol
LogP0.50
Rot. Bonds2

About [(2R)-6-methoxy-2-propan-2-yl-2,5-dihydropyrazin-3-yl]methanol

[(2R)-6-methoxy-2-propan-2-yl-2,5-dihydropyrazin-3-yl]methanol (PubChem CID 58356982) has the molecular formula C9H16N2O2 and a molecular weight of 184.24 g/mol. Its IUPAC name is [(2R)-6-methoxy-2-propan-2-yl-2,5-dihydropyrazin-3-yl]methanol.

Molecular Properties

Compound Name[(2R)-6-methoxy-2-propan-2-yl-2,5-dihydropyrazin-3-yl]methanol
PubChem CID58356982
Molecular FormulaC9H16N2O2
Molecular Weight184.24 g/mol
Exact Mass184.12
IUPAC Name[(2R)-6-methoxy-2-propan-2-yl-2,5-dihydropyrazin-3-yl]methanol
SMILESCOC1=N[C@H](C(C)C)C(CO)=NC1
InChIInChI=1S/C9H16N2O2/c1-6(2)9-7(5-12)10-4-8(11-9)13-3/h6,9,12H,4-5H2,1-3H3/t9-/m1/s1
InChIKeyGPCFCDPCFQISTH-SECBINFHSA-N
XLogP0.50
TPSA54.18 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.24
LogP ≤ 50.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [(2R)-6-methoxy-2-propan-2-yl-2,5-dihydropyrazin-3-yl]methanol?
The IUPAC name of [(2R)-6-methoxy-2-propan-2-yl-2,5-dihydropyrazin-3-yl]methanol (CID 58356982) is [(2R)-6-methoxy-2-propan-2-yl-2,5-dihydropyrazin-3-yl]methanol.
What is the SMILES notation for [(2R)-6-methoxy-2-propan-2-yl-2,5-dihydropyrazin-3-yl]methanol?
The canonical SMILES for [(2R)-6-methoxy-2-propan-2-yl-2,5-dihydropyrazin-3-yl]methanol is COC1=N[C@H](C(C)C)C(CO)=NC1.
What is the InChIKey of [(2R)-6-methoxy-2-propan-2-yl-2,5-dihydropyrazin-3-yl]methanol?
The InChIKey is GPCFCDPCFQISTH-SECBINFHSA-N. The full InChI is InChI=1S/C9H16N2O2/c1-6(2)9-7(5-12)10-4-8(11-9)13-3/h6,9,12H,4-5H2,1-3H3/t9-/m1/s1.
What are the key properties of [(2R)-6-methoxy-2-propan-2-yl-2,5-dihydropyrazin-3-yl]methanol?
[(2R)-6-methoxy-2-propan-2-yl-2,5-dihydropyrazin-3-yl]methanol has a molecular weight of 184.24 g/mol, XLogP of 0.50, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R)-6-methoxy-2-propan-2-yl-2,5-dihydropyrazin-3-yl]methanol is sourced from PubChem (CID 58356982), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).