5-(furan-2-yl)-N-[(3-hydroxyoxolan-3-yl)methyl]-1,2-oxazole-3-carboxamide

C13H14N2O5 — CID 103849044

IUPAC5-(furan-2-yl)-N-[(3-hydroxyoxolan-3-yl)methyl]-1,2-oxazole-3-carboxamide
SMILESO=C(NCC1(O)CCOC1)c1cc(-c2ccco2)on1
InChIInChI=1S/C13H14N2O5/c16-12(14-7-13(17)3-5-18-8-13)9-6-11(20-15-9)10-2-1-4-19-10/h1-2,4,6,17H,3,5,7-8H2,(H,14,16)
InChIKeyVSRXYTDXUYTDDC-UHFFFAOYSA-N
MW278.26 g/mol
LogP0.82
Rot. Bonds4

About 5-(furan-2-yl)-N-[(3-hydroxyoxolan-3-yl)methyl]-1,2-oxazole-3-carboxamide

5-(furan-2-yl)-N-[(3-hydroxyoxolan-3-yl)methyl]-1,2-oxazole-3-carboxamide (PubChem CID 103849044) has the molecular formula C13H14N2O5 and a molecular weight of 278.26 g/mol. Its IUPAC name is 5-(furan-2-yl)-N-[(3-hydroxyoxolan-3-yl)methyl]-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound Name5-(furan-2-yl)-N-[(3-hydroxyoxolan-3-yl)methyl]-1,2-oxazole-3-carboxamide
PubChem CID103849044
Molecular FormulaC13H14N2O5
Molecular Weight278.26 g/mol
Exact Mass278.09
IUPAC Name5-(furan-2-yl)-N-[(3-hydroxyoxolan-3-yl)methyl]-1,2-oxazole-3-carboxamide
SMILESO=C(NCC1(O)CCOC1)c1cc(-c2ccco2)on1
InChIInChI=1S/C13H14N2O5/c16-12(14-7-13(17)3-5-18-8-13)9-6-11(20-15-9)10-2-1-4-19-10/h1-2,4,6,17H,3,5,7-8H2,(H,14,16)
InChIKeyVSRXYTDXUYTDDC-UHFFFAOYSA-N
XLogP0.82
TPSA97.73 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.26
LogP ≤ 50.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-[(4-hydroxyoxan-4-yl)methyl]-5-phenyl-1,2-oxazole-3-carboxamide
CID 71788624
3-[[5-(furan-2-yl)-1,2-oxazole-3-carbonyl]amino]oxolane-3-carboxylic acid
CID 64888025
5-(furan-2-yl)-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]-1,2-oxazole-3-carboxamide
CID 120891466
5-(furan-2-yl)-N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-1,2-oxazole-3-carboxamide
CID 110302485
5-(furan-2-yl)-N-(2-methoxyethyl)-1,2-oxazole-3-carboxamide
CID 15995731
N-[(3-hydroxyoxolan-3-yl)methyl]-1,2,5-thiadiazole-3-carboxamide
CID 103849495
N-[(3-hydroxyoxolan-3-yl)methyl]-2-thiophen-3-yl-1,3-thiazole-4-carboxamide
CID 103849544
tert-butyl N-[1-[[[5-(furan-2-yl)-1,2-oxazole-3-carbonyl]amino]methyl]cyclohexyl]carbamate
CID 60618638
N-(3,3-difluoro-2-hydroxypropyl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide
CID 103770495
N-(2-amino-2-ethylbutyl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide
CID 119643486
5-(furan-2-yl)-N-(2-methylsulfonylethyl)-1,2-oxazole-3-carboxamide
CID 110357164
5-bromo-N-[(3-hydroxyoxolan-3-yl)methyl]furan-3-carboxamide
CID 84590622

Frequently Asked Questions

What is the IUPAC name of 5-(furan-2-yl)-N-[(3-hydroxyoxolan-3-yl)methyl]-1,2-oxazole-3-carboxamide?
The IUPAC name of 5-(furan-2-yl)-N-[(3-hydroxyoxolan-3-yl)methyl]-1,2-oxazole-3-carboxamide (CID 103849044) is 5-(furan-2-yl)-N-[(3-hydroxyoxolan-3-yl)methyl]-1,2-oxazole-3-carboxamide.
What is the SMILES notation for 5-(furan-2-yl)-N-[(3-hydroxyoxolan-3-yl)methyl]-1,2-oxazole-3-carboxamide?
The canonical SMILES for 5-(furan-2-yl)-N-[(3-hydroxyoxolan-3-yl)methyl]-1,2-oxazole-3-carboxamide is O=C(NCC1(O)CCOC1)c1cc(-c2ccco2)on1.
What is the InChIKey of 5-(furan-2-yl)-N-[(3-hydroxyoxolan-3-yl)methyl]-1,2-oxazole-3-carboxamide?
The InChIKey is VSRXYTDXUYTDDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O5/c16-12(14-7-13(17)3-5-18-8-13)9-6-11(20-15-9)10-2-1-4-19-10/h1-2,4,6,17H,3,5,7-8H2,(H,14,16).
What are the key properties of 5-(furan-2-yl)-N-[(3-hydroxyoxolan-3-yl)methyl]-1,2-oxazole-3-carboxamide?
5-(furan-2-yl)-N-[(3-hydroxyoxolan-3-yl)methyl]-1,2-oxazole-3-carboxamide has a molecular weight of 278.26 g/mol, XLogP of 0.82, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(furan-2-yl)-N-[(3-hydroxyoxolan-3-yl)methyl]-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 103849044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).