N'-(2-ethylphenyl)-N-[2-(furan-2-yl)-2-hydroxyethyl]oxamide

C16H18N2O4 — CID 110893787

IUPACN'-(2-ethylphenyl)-N-[2-(furan-2-yl)-2-hydroxyethyl]oxamide
SMILESCCc1ccccc1NC(=O)C(=O)NCC(O)c1ccco1
InChIInChI=1S/C16H18N2O4/c1-2-11-6-3-4-7-12(11)18-16(21)15(20)17-10-13(19)14-8-5-9-22-14/h3-9,13,19H,2,10H2,1H3,(H,17,20)(H,18,21)
InChIKeySXRUUFSFBKZLMD-UHFFFAOYSA-N
MW302.33 g/mol
LogP1.63
Rot. Bonds5

About N'-(2-ethylphenyl)-N-[2-(furan-2-yl)-2-hydroxyethyl]oxamide

N'-(2-ethylphenyl)-N-[2-(furan-2-yl)-2-hydroxyethyl]oxamide (PubChem CID 110893787) has the molecular formula C16H18N2O4 and a molecular weight of 302.33 g/mol. Its IUPAC name is N'-(2-ethylphenyl)-N-[2-(furan-2-yl)-2-hydroxyethyl]oxamide.

Molecular Properties

Compound NameN'-(2-ethylphenyl)-N-[2-(furan-2-yl)-2-hydroxyethyl]oxamide
PubChem CID110893787
Molecular FormulaC16H18N2O4
Molecular Weight302.33 g/mol
Exact Mass302.13
IUPAC NameN'-(2-ethylphenyl)-N-[2-(furan-2-yl)-2-hydroxyethyl]oxamide
SMILESCCc1ccccc1NC(=O)C(=O)NCC(O)c1ccco1
InChIInChI=1S/C16H18N2O4/c1-2-11-6-3-4-7-12(11)18-16(21)15(20)17-10-13(19)14-8-5-9-22-14/h3-9,13,19H,2,10H2,1H3,(H,17,20)(H,18,21)
InChIKeySXRUUFSFBKZLMD-UHFFFAOYSA-N
XLogP1.63
TPSA91.57 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.33
LogP ≤ 51.63
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N'-(2,6-diethylphenyl)-N-[2-(furan-2-yl)-2-hydroxyethyl]oxamide
CID 110893782
N'-(2-fluorophenyl)-N-[2-(furan-2-yl)-2-hydroxyethyl]oxamide
CID 110893763
2-(2-ethylanilino)-1-(furan-2-yl)ethanol
CID 55025106
N'-(2-ethylphenyl)-N-(2-hydroxy-3,3-dimethylbutyl)oxamide
CID 111121541
N-(2-ethylhexyl)-N'-(2-ethylphenyl)oxamide
CID 4656011
2-(2-ethylphenoxy)-N-[2-(furan-2-yl)-2-hydroxyethyl]acetamide
CID 86981092
N-(2-ethylphenyl)furan-2-carboxamide
CID 763274
N'-(3-chloro-4-methylphenyl)-N-[2-(furan-2-yl)-2-hydroxyethyl]oxamide
CID 110893757
N'-(2,3-dimethylphenyl)-N-[3-(furan-2-yl)-3-hydroxypropyl]oxamide
CID 71787744
1-(3-chloro-2-methoxyphenyl)-3-[2-(furan-2-yl)-2-hydroxyethyl]urea
CID 110903965
N-ethyl-N'-[2-(furan-2-yl)-2-hydroxyethyl]pentanediamide
CID 111102313
5-ethyl-N-[2-(furan-2-yl)-2-hydroxyethyl]furan-2-carboxamide
CID 110888986

Frequently Asked Questions

What is the IUPAC name of N'-(2-ethylphenyl)-N-[2-(furan-2-yl)-2-hydroxyethyl]oxamide?
The IUPAC name of N'-(2-ethylphenyl)-N-[2-(furan-2-yl)-2-hydroxyethyl]oxamide (CID 110893787) is N'-(2-ethylphenyl)-N-[2-(furan-2-yl)-2-hydroxyethyl]oxamide.
What is the SMILES notation for N'-(2-ethylphenyl)-N-[2-(furan-2-yl)-2-hydroxyethyl]oxamide?
The canonical SMILES for N'-(2-ethylphenyl)-N-[2-(furan-2-yl)-2-hydroxyethyl]oxamide is CCc1ccccc1NC(=O)C(=O)NCC(O)c1ccco1.
What is the InChIKey of N'-(2-ethylphenyl)-N-[2-(furan-2-yl)-2-hydroxyethyl]oxamide?
The InChIKey is SXRUUFSFBKZLMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O4/c1-2-11-6-3-4-7-12(11)18-16(21)15(20)17-10-13(19)14-8-5-9-22-14/h3-9,13,19H,2,10H2,1H3,(H,17,20)(H,18,21).
What are the key properties of N'-(2-ethylphenyl)-N-[2-(furan-2-yl)-2-hydroxyethyl]oxamide?
N'-(2-ethylphenyl)-N-[2-(furan-2-yl)-2-hydroxyethyl]oxamide has a molecular weight of 302.33 g/mol, XLogP of 1.63, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2-ethylphenyl)-N-[2-(furan-2-yl)-2-hydroxyethyl]oxamide is sourced from PubChem (CID 110893787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).