[5-[(1,2-oxazol-3-ylmethylamino)methyl]furan-2-yl]methanol

C10H12N2O3 — CID 79496028

IUPAC[5-[(1,2-oxazol-3-ylmethylamino)methyl]furan-2-yl]methanol
SMILESOCc1ccc(CNCc2ccon2)o1
InChIInChI=1S/C10H12N2O3/c13-7-10-2-1-9(15-10)6-11-5-8-3-4-14-12-8/h1-4,11,13H,5-7H2
InChIKeyLSGKDPWYWOGHPK-UHFFFAOYSA-N
MW208.22 g/mol
LogP1.05
Rot. Bonds5

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

[5-[(1,2-oxazol-3-ylmethylamino)methyl]furan-2-yl]methanol (PubChem CID 79496028) has the molecular formula C10H12N2O3 and a molecular weight of 208.22 g/mol. Its IUPAC name is [5-[(1,2-oxazol-3-ylmethylamino)methyl]furan-2-yl]methanol.

Molecular Properties

Compound Name[5-[(1,2-oxazol-3-ylmethylamino)methyl]furan-2-yl]methanol
PubChem CID79496028
Molecular FormulaC10H12N2O3
Molecular Weight208.22 g/mol
Exact Mass208.08
IUPAC Name[5-[(1,2-oxazol-3-ylmethylamino)methyl]furan-2-yl]methanol
SMILESOCc1ccc(CNCc2ccon2)o1
InChIInChI=1S/C10H12N2O3/c13-7-10-2-1-9(15-10)6-11-5-8-3-4-14-12-8/h1-4,11,13H,5-7H2
InChIKeyLSGKDPWYWOGHPK-UHFFFAOYSA-N
XLogP1.05
TPSA71.43 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.22
LogP ≤ 51.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [5-[(1,2-oxazol-3-ylmethylamino)methyl]furan-2-yl]methanol?
The IUPAC name of [5-[(1,2-oxazol-3-ylmethylamino)methyl]furan-2-yl]methanol (CID 79496028) is [5-[(1,2-oxazol-3-ylmethylamino)methyl]furan-2-yl]methanol.
What is the SMILES notation for [5-[(1,2-oxazol-3-ylmethylamino)methyl]furan-2-yl]methanol?
The canonical SMILES for [5-[(1,2-oxazol-3-ylmethylamino)methyl]furan-2-yl]methanol is OCc1ccc(CNCc2ccon2)o1.
What is the InChIKey of [5-[(1,2-oxazol-3-ylmethylamino)methyl]furan-2-yl]methanol?
The InChIKey is LSGKDPWYWOGHPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2O3/c13-7-10-2-1-9(15-10)6-11-5-8-3-4-14-12-8/h1-4,11,13H,5-7H2.
What are the key properties of [5-[(1,2-oxazol-3-ylmethylamino)methyl]furan-2-yl]methanol?
[5-[(1,2-oxazol-3-ylmethylamino)methyl]furan-2-yl]methanol has a molecular weight of 208.22 g/mol, XLogP of 1.05, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [5-[(1,2-oxazol-3-ylmethylamino)methyl]furan-2-yl]methanol is sourced from PubChem (CID 79496028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).