1-(1,2-oxazol-5-yl)undecan-1-ol

C14H25NO2 — CID 135037413

IUPAC1-(1,2-oxazol-5-yl)undecan-1-ol
SMILESCCCCCCCCCCC(O)c1ccno1
InChIInChI=1S/C14H25NO2/c1-2-3-4-5-6-7-8-9-10-13(16)14-11-12-15-17-14/h11-13,16H,2-10H2,1H3
InChIKeyUKYRSXUZJOUXIH-UHFFFAOYSA-N
MW239.36 g/mol
LogP4.24
Rot. Bonds10

About 1-(1,2-oxazol-5-yl)undecan-1-ol

1-(1,2-oxazol-5-yl)undecan-1-ol (PubChem CID 135037413) has the molecular formula C14H25NO2 and a molecular weight of 239.36 g/mol. Its IUPAC name is 1-(1,2-oxazol-5-yl)undecan-1-ol.

Molecular Properties

Compound Name1-(1,2-oxazol-5-yl)undecan-1-ol
PubChem CID135037413
Molecular FormulaC14H25NO2
Molecular Weight239.36 g/mol
Exact Mass239.19
IUPAC Name1-(1,2-oxazol-5-yl)undecan-1-ol
SMILESCCCCCCCCCCC(O)c1ccno1
InChIInChI=1S/C14H25NO2/c1-2-3-4-5-6-7-8-9-10-13(16)14-11-12-15-17-14/h11-13,16H,2-10H2,1H3
InChIKeyUKYRSXUZJOUXIH-UHFFFAOYSA-N
XLogP4.24
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 ≤ 54.24
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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Related Compounds

5-Octyl-1,2-oxazole
CID 86100028
4,4-Difluoro-1-(1,2-oxazol-5-yl)cyclohexan-1-ol
CID 175788019
(1R)-4,4,4-trifluoro-1-(1,2-oxazol-5-yl)butan-1-ol
CID 125514912
(1S)-4,4,4-trifluoro-1-(1,2-oxazol-5-yl)butan-1-ol
CID 125514913
4,4,4-Trifluoro-1-(1,2-oxazol-5-yl)butan-1-ol
CID 165438425
(3-Nonyl-1,2-oxazol-5-yl)methanol
CID 10878840
(3-Pentyl-1,2-oxazol-5-yl)methanol
CID 12045694
5-Isoxazolemethanol, 3-dodecyl-
CID 10635553
(3-Butyl-1,2-oxazol-5-yl)methanol
CID 12045691
1-(Isoxazol-5-yl)butane-1,4-diol
CID 17966205
3-(1-Decyl)-5-isoxazolemethanol
CID 18372945
1-(3-Propyl-1,2-oxazol-5-yl)propan-1-ol
CID 19976894

Frequently Asked Questions

What is the IUPAC name of 1-(1,2-oxazol-5-yl)undecan-1-ol?
The IUPAC name of 1-(1,2-oxazol-5-yl)undecan-1-ol (CID 135037413) is 1-(1,2-oxazol-5-yl)undecan-1-ol.
What is the SMILES notation for 1-(1,2-oxazol-5-yl)undecan-1-ol?
The canonical SMILES for 1-(1,2-oxazol-5-yl)undecan-1-ol is CCCCCCCCCCC(O)c1ccno1.
What is the InChIKey of 1-(1,2-oxazol-5-yl)undecan-1-ol?
The InChIKey is UKYRSXUZJOUXIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25NO2/c1-2-3-4-5-6-7-8-9-10-13(16)14-11-12-15-17-14/h11-13,16H,2-10H2,1H3.
What are the key properties of 1-(1,2-oxazol-5-yl)undecan-1-ol?
1-(1,2-oxazol-5-yl)undecan-1-ol has a molecular weight of 239.36 g/mol, XLogP of 4.24, 10 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1,2-oxazol-5-yl)undecan-1-ol is sourced from PubChem (CID 135037413), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).