[2-[(Z)-2-(furan-2-yl)ethenyl]-1,3-benzoxazol-6-yl]methanol

C14H11NO3 — CID 82357834

IUPAC[2-[(Z)-2-(furan-2-yl)ethenyl]-1,3-benzoxazol-6-yl]methanol
SMILESOCc1ccc2nc(/C=C\c3ccco3)oc2c1
InChIInChI=1S/C14H11NO3/c16-9-10-3-5-12-13(8-10)18-14(15-12)6-4-11-2-1-7-17-11/h1-8,16H,9H2/b6-4-
InChIKeyHXKAXJOWXZLMCH-XQRVVYSFSA-N
MW241.25 g/mol
LogP3.08
Rot. Bonds3

About [2-[(Z)-2-(furan-2-yl)ethenyl]-1,3-benzoxazol-6-yl]methanol

[2-[(Z)-2-(furan-2-yl)ethenyl]-1,3-benzoxazol-6-yl]methanol (PubChem CID 82357834) has the molecular formula C14H11NO3 and a molecular weight of 241.25 g/mol. Its IUPAC name is [2-[(Z)-2-(furan-2-yl)ethenyl]-1,3-benzoxazol-6-yl]methanol.

Molecular Properties

Compound Name[2-[(Z)-2-(furan-2-yl)ethenyl]-1,3-benzoxazol-6-yl]methanol
PubChem CID82357834
Molecular FormulaC14H11NO3
Molecular Weight241.25 g/mol
Exact Mass241.07
IUPAC Name[2-[(Z)-2-(furan-2-yl)ethenyl]-1,3-benzoxazol-6-yl]methanol
SMILESOCc1ccc2nc(/C=C\c3ccco3)oc2c1
InChIInChI=1S/C14H11NO3/c16-9-10-3-5-12-13(8-10)18-14(15-12)6-4-11-2-1-7-17-11/h1-8,16H,9H2/b6-4-
InChIKeyHXKAXJOWXZLMCH-XQRVVYSFSA-N
XLogP3.08
TPSA59.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.25
LogP ≤ 53.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[2-[(E)-2-(4-chlorophenyl)ethenyl]-1,3-benzoxazol-5-yl]methanol
CID 82357890
1-[2-[(E)-2-(4-fluorophenyl)ethenyl]-1,3-benzoxazol-6-yl]-N-methylmethanamine
CID 82357595
(2-propyl-1,3-benzoxazol-6-yl)methanol
CID 82357761
[2-(phenoxymethyl)-1,3-benzoxazol-6-yl]methanol
CID 82357792
6-ethyl-1,3-benzoxazole-2-carbaldehyde
CID 130870252
[2-(furan-2-yl)-1,3-benzoxazol-6-yl]methanamine
CID 82357432
2-[2-[2-[2-(furan-2-yl)ethenyl]phenyl]ethenyl]furan
CID 91360504
[2-(4-methoxyphenyl)-1,3-benzoxazol-6-yl]methanol
CID 15629818
2-[(Z)-2-naphthalen-1-ylethenyl]furan
CID 12649067
[2-[(2,5-dimethylphenoxy)methyl]-1,3-benzoxazol-6-yl]methanol
CID 82357809
2-[2-[3,5,6-tris[2-(1,3-benzoxazol-2-yl)ethenyl]pyrazin-2-yl]ethenyl]-1,3-benzoxazole
CID 57286159
[2-(3,4-dimethoxyphenyl)-1,3-benzoxazol-6-yl]methanol
CID 82357784

Frequently Asked Questions

What is the IUPAC name of [2-[(Z)-2-(furan-2-yl)ethenyl]-1,3-benzoxazol-6-yl]methanol?
The IUPAC name of [2-[(Z)-2-(furan-2-yl)ethenyl]-1,3-benzoxazol-6-yl]methanol (CID 82357834) is [2-[(Z)-2-(furan-2-yl)ethenyl]-1,3-benzoxazol-6-yl]methanol.
What is the SMILES notation for [2-[(Z)-2-(furan-2-yl)ethenyl]-1,3-benzoxazol-6-yl]methanol?
The canonical SMILES for [2-[(Z)-2-(furan-2-yl)ethenyl]-1,3-benzoxazol-6-yl]methanol is OCc1ccc2nc(/C=C\c3ccco3)oc2c1.
What is the InChIKey of [2-[(Z)-2-(furan-2-yl)ethenyl]-1,3-benzoxazol-6-yl]methanol?
The InChIKey is HXKAXJOWXZLMCH-XQRVVYSFSA-N. The full InChI is InChI=1S/C14H11NO3/c16-9-10-3-5-12-13(8-10)18-14(15-12)6-4-11-2-1-7-17-11/h1-8,16H,9H2/b6-4-.
What are the key properties of [2-[(Z)-2-(furan-2-yl)ethenyl]-1,3-benzoxazol-6-yl]methanol?
[2-[(Z)-2-(furan-2-yl)ethenyl]-1,3-benzoxazol-6-yl]methanol has a molecular weight of 241.25 g/mol, XLogP of 3.08, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(Z)-2-(furan-2-yl)ethenyl]-1,3-benzoxazol-6-yl]methanol is sourced from PubChem (CID 82357834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).