N-(furan-2-ylmethyl)-N'-(1-phenylethyl)oxamide

C15H16N2O3 — CID 2851681

IUPACN-(furan-2-ylmethyl)-N'-(1-phenylethyl)oxamide
SMILESCC(NC(=O)C(=O)NCc1ccco1)c1ccccc1
InChIInChI=1S/C15H16N2O3/c1-11(12-6-3-2-4-7-12)17-15(19)14(18)16-10-13-8-5-9-20-13/h2-9,11H,10H2,1H3,(H,16,18)(H,17,19)
InChIKeyISLAESJXVIAJMH-UHFFFAOYSA-N
MW272.30 g/mol
LogP1.77
Rot. Bonds4

About N-(furan-2-ylmethyl)-N'-(1-phenylethyl)oxamide

N-(furan-2-ylmethyl)-N'-(1-phenylethyl)oxamide (PubChem CID 2851681) has the molecular formula C15H16N2O3 and a molecular weight of 272.30 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-N'-(1-phenylethyl)oxamide.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-N'-(1-phenylethyl)oxamide
PubChem CID2851681
Molecular FormulaC15H16N2O3
Molecular Weight272.30 g/mol
Exact Mass272.12
IUPAC NameN-(furan-2-ylmethyl)-N'-(1-phenylethyl)oxamide
SMILESCC(NC(=O)C(=O)NCc1ccco1)c1ccccc1
InChIInChI=1S/C15H16N2O3/c1-11(12-6-3-2-4-7-12)17-15(19)14(18)16-10-13-8-5-9-20-13/h2-9,11H,10H2,1H3,(H,16,18)(H,17,19)
InChIKeyISLAESJXVIAJMH-UHFFFAOYSA-N
XLogP1.77
TPSA71.34 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.30
LogP ≤ 51.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'diketo_group', 'substructure': 'N/A'}

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Related Compounds

N'-[(1R)-1-(4-fluorophenyl)ethyl]-N-(furan-2-ylmethyl)oxamide
CID 30405106
N'-[1-(4-ethylphenyl)ethyl]-N-(furan-2-ylmethyl)oxamide
CID 108510944
N-(furan-2-ylmethyl)-N'-[(1R)-1-(2,4,5-trimethylphenyl)ethyl]oxamide
CID 30405111
1-(furan-2-ylmethyl)-2-methyl-3-(1-phenylethyl)guanidine;hydroiodide
CID 110948927
N-[(2R)-2-(furan-2-yl)-2-methoxyethyl]-N'-[(1R)-1-phenylethyl]oxamide
CID 99876519
N-[[5-(furan-2-carbonyl)thiophen-2-yl]methyl]-N'-[(1R)-1-phenylethyl]oxamide
CID 99873315
2-[[(furan-2-ylmethylamino)-(1-phenylethylamino)methylidene]amino]-N,N-dimethylacetamide;hydroiodide
CID 111491389
N-(furan-2-ylmethyl)-N'-[(1R)-1-(4-methoxyphenyl)-2-methylpropyl]oxamide
CID 124878229
N-[(2R)-2-hydroxypropyl]-N'-[(1S)-1-phenylethyl]oxamide
CID 2291148
(2S)-N-(furan-2-ylmethyl)-2-phenylbutanamide
CID 40538690
3-(furan-2-ylmethyl)-1-methyl-1-[(1S)-1-phenylethyl]urea
CID 51729179
3-(furan-2-ylmethylamino)-4-[[(1S)-1-phenylethyl]amino]cyclobut-3-ene-1,2-dione
CID 71964875

Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-N'-(1-phenylethyl)oxamide?
The IUPAC name of N-(furan-2-ylmethyl)-N'-(1-phenylethyl)oxamide (CID 2851681) is N-(furan-2-ylmethyl)-N'-(1-phenylethyl)oxamide.
What is the SMILES notation for N-(furan-2-ylmethyl)-N'-(1-phenylethyl)oxamide?
The canonical SMILES for N-(furan-2-ylmethyl)-N'-(1-phenylethyl)oxamide is CC(NC(=O)C(=O)NCc1ccco1)c1ccccc1.
What is the InChIKey of N-(furan-2-ylmethyl)-N'-(1-phenylethyl)oxamide?
The InChIKey is ISLAESJXVIAJMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O3/c1-11(12-6-3-2-4-7-12)17-15(19)14(18)16-10-13-8-5-9-20-13/h2-9,11H,10H2,1H3,(H,16,18)(H,17,19).
What are the key properties of N-(furan-2-ylmethyl)-N'-(1-phenylethyl)oxamide?
N-(furan-2-ylmethyl)-N'-(1-phenylethyl)oxamide has a molecular weight of 272.30 g/mol, XLogP of 1.77, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)-N'-(1-phenylethyl)oxamide is sourced from PubChem (CID 2851681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).