(3-decyl-1,2-oxazol-5-yl)methanol

C14H25NO2 — CID 18372945

IUPAC(3-decyl-1,2-oxazol-5-yl)methanol
SMILESCCCCCCCCCCc1cc(CO)on1
InChIInChI=1S/C14H25NO2/c1-2-3-4-5-6-7-8-9-10-13-11-14(12-16)17-15-13/h11,16H,2-10,12H2,1H3
InChIKeyFXLOKVHMXBOHOK-UHFFFAOYSA-N
MW239.36 g/mol
LogP3.85
Rot. Bonds10

About (3-decyl-1,2-oxazol-5-yl)methanol

(3-decyl-1,2-oxazol-5-yl)methanol (PubChem CID 18372945) has the molecular formula C14H25NO2 and a molecular weight of 239.36 g/mol. Its IUPAC name is (3-decyl-1,2-oxazol-5-yl)methanol.

Molecular Properties

Compound Name(3-decyl-1,2-oxazol-5-yl)methanol
PubChem CID18372945
Molecular FormulaC14H25NO2
Molecular Weight239.36 g/mol
Exact Mass239.19
IUPAC Name(3-decyl-1,2-oxazol-5-yl)methanol
SMILESCCCCCCCCCCc1cc(CO)on1
InChIInChI=1S/C14H25NO2/c1-2-3-4-5-6-7-8-9-10-13-11-14(12-16)17-15-13/h11,16H,2-10,12H2,1H3
InChIKeyFXLOKVHMXBOHOK-UHFFFAOYSA-N
XLogP3.85
TPSA46.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.36
LogP ≤ 53.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (3-decyl-1,2-oxazol-5-yl)methanol?
The IUPAC name of (3-decyl-1,2-oxazol-5-yl)methanol (CID 18372945) is (3-decyl-1,2-oxazol-5-yl)methanol.
What is the SMILES notation for (3-decyl-1,2-oxazol-5-yl)methanol?
The canonical SMILES for (3-decyl-1,2-oxazol-5-yl)methanol is CCCCCCCCCCc1cc(CO)on1.
What is the InChIKey of (3-decyl-1,2-oxazol-5-yl)methanol?
The InChIKey is FXLOKVHMXBOHOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25NO2/c1-2-3-4-5-6-7-8-9-10-13-11-14(12-16)17-15-13/h11,16H,2-10,12H2,1H3.
What are the key properties of (3-decyl-1,2-oxazol-5-yl)methanol?
(3-decyl-1,2-oxazol-5-yl)methanol has a molecular weight of 239.36 g/mol, XLogP of 3.85, 10 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3-decyl-1,2-oxazol-5-yl)methanol is sourced from PubChem (CID 18372945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).