[5-(1-benzofuran-2-yl)-1,3-oxazol-4-yl]methanol

C12H9NO3 — CID 79145508

IUPAC[5-(1-benzofuran-2-yl)-1,3-oxazol-4-yl]methanol
SMILESOCc1ncoc1-c1cc2ccccc2o1
InChIInChI=1S/C12H9NO3/c14-6-9-12(15-7-13-9)11-5-8-3-1-2-4-10(8)16-11/h1-5,7,14H,6H2
InChIKeyPBFAMVDNFTYTID-UHFFFAOYSA-N
MW215.21 g/mol
LogP2.58
Rot. Bonds2

About [5-(1-benzofuran-2-yl)-1,3-oxazol-4-yl]methanol

[5-(1-benzofuran-2-yl)-1,3-oxazol-4-yl]methanol (PubChem CID 79145508) has the molecular formula C12H9NO3 and a molecular weight of 215.21 g/mol. Its IUPAC name is [5-(1-benzofuran-2-yl)-1,3-oxazol-4-yl]methanol.

Molecular Properties

Compound Name[5-(1-benzofuran-2-yl)-1,3-oxazol-4-yl]methanol
PubChem CID79145508
Molecular FormulaC12H9NO3
Molecular Weight215.21 g/mol
Exact Mass215.06
IUPAC Name[5-(1-benzofuran-2-yl)-1,3-oxazol-4-yl]methanol
SMILESOCc1ncoc1-c1cc2ccccc2o1
InChIInChI=1S/C12H9NO3/c14-6-9-12(15-7-13-9)11-5-8-3-1-2-4-10(8)16-11/h1-5,7,14H,6H2
InChIKeyPBFAMVDNFTYTID-UHFFFAOYSA-N
XLogP2.58
TPSA59.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.21
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze [5-(1-benzofuran-2-yl)-1,3-oxazol-4-yl]methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[[5-(1-benzofuran-2-yl)-1,3-oxazol-4-yl]methyl]propan-1-amine
CID 79145257
2,5-bis(1-benzofuran-2-yl)pyrazine
CID 86184221
3-(hydroxymethyl)chromen-2-one
CID 22921481
N-[[2-(1-benzofuran-2-yl)-4-(methoxymethyl)-1,3-thiazol-5-yl]methyl]ethanamine
CID 114366260
3-(1-benzofuran-2-yl)imidazo[1,2-b]pyridazin-6-amine
CID 90317489
2-(1-benzofuran-2-yl)-3-phenylquinoxaline
CID 20787617
2-[2-(1-benzofuran-2-yl)pyrimidin-5-yl]acetic acid
CID 82381604
2-[4-(1-benzofuran-2-yl)-2,5-dichlorophenyl]-1-benzofuran
CID 67296045
4-(1-benzofuran-2-yl)-5-bromobenzene-1,2-diol
CID 118731476
3-(1-benzofuran-2-yl)pyrazin-2-amine
CID 114734408
2-(1-benzofuran-2-yl)-1,3-benzoxazole
CID 9323121
2,4-bis(1-benzofuran-2-yl)-6-chloro-1,3,5-triazine
CID 176645637

Frequently Asked Questions

What is the IUPAC name of [5-(1-benzofuran-2-yl)-1,3-oxazol-4-yl]methanol?
The IUPAC name of [5-(1-benzofuran-2-yl)-1,3-oxazol-4-yl]methanol (CID 79145508) is [5-(1-benzofuran-2-yl)-1,3-oxazol-4-yl]methanol.
What is the SMILES notation for [5-(1-benzofuran-2-yl)-1,3-oxazol-4-yl]methanol?
The canonical SMILES for [5-(1-benzofuran-2-yl)-1,3-oxazol-4-yl]methanol is OCc1ncoc1-c1cc2ccccc2o1.
What is the InChIKey of [5-(1-benzofuran-2-yl)-1,3-oxazol-4-yl]methanol?
The InChIKey is PBFAMVDNFTYTID-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9NO3/c14-6-9-12(15-7-13-9)11-5-8-3-1-2-4-10(8)16-11/h1-5,7,14H,6H2.
What are the key properties of [5-(1-benzofuran-2-yl)-1,3-oxazol-4-yl]methanol?
[5-(1-benzofuran-2-yl)-1,3-oxazol-4-yl]methanol has a molecular weight of 215.21 g/mol, XLogP of 2.58, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(1-benzofuran-2-yl)-1,3-oxazol-4-yl]methanol is sourced from PubChem (CID 79145508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).