N-[3-(furan-2-yl)-2-hydroxy-2-methylpropyl]-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide

C17H18N2O5 — CID 90605048

IUPACN-[3-(furan-2-yl)-2-hydroxy-2-methylpropyl]-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide
SMILESCC(O)(CNC(=O)Cn1c(=O)oc2ccccc21)Cc1ccco1
InChIInChI=1S/C17H18N2O5/c1-17(22,9-12-5-4-8-23-12)11-18-15(20)10-19-13-6-2-3-7-14(13)24-16(19)21/h2-8,22H,9-11H2,1H3,(H,18,20)
InChIKeyGRIKRVJKXVWDGY-UHFFFAOYSA-N
MW330.34 g/mol
LogP1.30
Rot. Bonds6

About N-[3-(furan-2-yl)-2-hydroxy-2-methylpropyl]-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide

N-[3-(furan-2-yl)-2-hydroxy-2-methylpropyl]-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide (PubChem CID 90605048) has the molecular formula C17H18N2O5 and a molecular weight of 330.34 g/mol. Its IUPAC name is N-[3-(furan-2-yl)-2-hydroxy-2-methylpropyl]-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide.

Molecular Properties

Compound NameN-[3-(furan-2-yl)-2-hydroxy-2-methylpropyl]-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide
PubChem CID90605048
Molecular FormulaC17H18N2O5
Molecular Weight330.34 g/mol
Exact Mass330.12
IUPAC NameN-[3-(furan-2-yl)-2-hydroxy-2-methylpropyl]-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide
SMILESCC(O)(CNC(=O)Cn1c(=O)oc2ccccc21)Cc1ccco1
InChIInChI=1S/C17H18N2O5/c1-17(22,9-12-5-4-8-23-12)11-18-15(20)10-19-13-6-2-3-7-14(13)24-16(19)21/h2-8,22H,9-11H2,1H3,(H,18,20)
InChIKeyGRIKRVJKXVWDGY-UHFFFAOYSA-N
XLogP1.30
TPSA97.61 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.34
LogP ≤ 51.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-[(2R)-2-cyclopropyl-2-hydroxypropyl]-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide
CID 52907105
N-(furan-2-ylmethylcarbamoyl)-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide
CID 2124377
N-[2-[butan-2-yl(furan-2-ylmethyl)amino]ethyl]-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide
CID 20949240
N-butyl-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide
CID 4808042
N-[(2R)-3-(furan-2-yl)-2-hydroxy-2-methylpropyl]-1-benzofuran-2-carboxamide
CID 99872573
2-methyl-2-[[2-(2-oxo-1,3-benzoxazol-3-yl)acetyl]amino]propanoic acid
CID 61262096
N-[(2S)-2-cyclopropyl-2-hydroxy-2-phenylethyl]-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide
CID 95379441
N-[(2R)-3-(furan-2-yl)-2-hydroxy-2-methylpropyl]-2-phenoxyacetamide
CID 99872555
N-(2-methoxyethyl)-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide
CID 3580508
N-[3-(furan-2-yl)-2-hydroxy-2-methylpropyl]-2,2-diphenylacetamide
CID 90605067
N-(2-ethylbutyl)-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide
CID 115612682
N-[2-(furan-3-yl)-2-hydroxy-2-thiophen-2-ylethyl]-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide
CID 119101192

Frequently Asked Questions

What is the IUPAC name of N-[3-(furan-2-yl)-2-hydroxy-2-methylpropyl]-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide?
The IUPAC name of N-[3-(furan-2-yl)-2-hydroxy-2-methylpropyl]-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide (CID 90605048) is N-[3-(furan-2-yl)-2-hydroxy-2-methylpropyl]-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide.
What is the SMILES notation for N-[3-(furan-2-yl)-2-hydroxy-2-methylpropyl]-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide?
The canonical SMILES for N-[3-(furan-2-yl)-2-hydroxy-2-methylpropyl]-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide is CC(O)(CNC(=O)Cn1c(=O)oc2ccccc21)Cc1ccco1.
What is the InChIKey of N-[3-(furan-2-yl)-2-hydroxy-2-methylpropyl]-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide?
The InChIKey is GRIKRVJKXVWDGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O5/c1-17(22,9-12-5-4-8-23-12)11-18-15(20)10-19-13-6-2-3-7-14(13)24-16(19)21/h2-8,22H,9-11H2,1H3,(H,18,20).
What are the key properties of N-[3-(furan-2-yl)-2-hydroxy-2-methylpropyl]-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide?
N-[3-(furan-2-yl)-2-hydroxy-2-methylpropyl]-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide has a molecular weight of 330.34 g/mol, XLogP of 1.30, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(furan-2-yl)-2-hydroxy-2-methylpropyl]-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide is sourced from PubChem (CID 90605048), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).