[(4R)-2-(furan-3-yl)-4-methyl-5H-1,3-oxazol-4-yl]methanol

C9H11NO3 — CID 130809019

IUPAC[(4R)-2-(furan-3-yl)-4-methyl-5H-1,3-oxazol-4-yl]methanol
SMILESC[C@@]1(CO)COC(c2ccoc2)=N1
InChIInChI=1S/C9H11NO3/c1-9(5-11)6-13-8(10-9)7-2-3-12-4-7/h2-4,11H,5-6H2,1H3/t9-/m1/s1
InChIKeyCZAYRHUSDBCVPK-SECBINFHSA-N
MW181.19 g/mol
LogP0.81
Rot. Bonds2

About [(4R)-2-(furan-3-yl)-4-methyl-5H-1,3-oxazol-4-yl]methanol

[(4R)-2-(furan-3-yl)-4-methyl-5H-1,3-oxazol-4-yl]methanol (PubChem CID 130809019) has the molecular formula C9H11NO3 and a molecular weight of 181.19 g/mol. Its IUPAC name is [(4R)-2-(furan-3-yl)-4-methyl-5H-1,3-oxazol-4-yl]methanol.

Molecular Properties

Compound Name[(4R)-2-(furan-3-yl)-4-methyl-5H-1,3-oxazol-4-yl]methanol
PubChem CID130809019
Molecular FormulaC9H11NO3
Molecular Weight181.19 g/mol
Exact Mass181.07
IUPAC Name[(4R)-2-(furan-3-yl)-4-methyl-5H-1,3-oxazol-4-yl]methanol
SMILESC[C@@]1(CO)COC(c2ccoc2)=N1
InChIInChI=1S/C9H11NO3/c1-9(5-11)6-13-8(10-9)7-2-3-12-4-7/h2-4,11H,5-6H2,1H3/t9-/m1/s1
InChIKeyCZAYRHUSDBCVPK-SECBINFHSA-N
XLogP0.81
TPSA54.96 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.19
LogP ≤ 50.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [(4R)-2-(furan-3-yl)-4-methyl-5H-1,3-oxazol-4-yl]methanol?
The IUPAC name of [(4R)-2-(furan-3-yl)-4-methyl-5H-1,3-oxazol-4-yl]methanol (CID 130809019) is [(4R)-2-(furan-3-yl)-4-methyl-5H-1,3-oxazol-4-yl]methanol.
What is the SMILES notation for [(4R)-2-(furan-3-yl)-4-methyl-5H-1,3-oxazol-4-yl]methanol?
The canonical SMILES for [(4R)-2-(furan-3-yl)-4-methyl-5H-1,3-oxazol-4-yl]methanol is C[C@@]1(CO)COC(c2ccoc2)=N1.
What is the InChIKey of [(4R)-2-(furan-3-yl)-4-methyl-5H-1,3-oxazol-4-yl]methanol?
The InChIKey is CZAYRHUSDBCVPK-SECBINFHSA-N. The full InChI is InChI=1S/C9H11NO3/c1-9(5-11)6-13-8(10-9)7-2-3-12-4-7/h2-4,11H,5-6H2,1H3/t9-/m1/s1.
What are the key properties of [(4R)-2-(furan-3-yl)-4-methyl-5H-1,3-oxazol-4-yl]methanol?
[(4R)-2-(furan-3-yl)-4-methyl-5H-1,3-oxazol-4-yl]methanol has a molecular weight of 181.19 g/mol, XLogP of 0.81, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(4R)-2-(furan-3-yl)-4-methyl-5H-1,3-oxazol-4-yl]methanol is sourced from PubChem (CID 130809019), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).