N'-[1-(furan-2-yl)propan-2-yl]-N-(2-methylphenyl)oxamide

C16H18N2O3 — CID 121084178

IUPACN'-[1-(furan-2-yl)propan-2-yl]-N-(2-methylphenyl)oxamide
SMILESCc1ccccc1NC(=O)C(=O)NC(C)Cc1ccco1
InChIInChI=1S/C16H18N2O3/c1-11-6-3-4-8-14(11)18-16(20)15(19)17-12(2)10-13-7-5-9-21-13/h3-9,12H,10H2,1-2H3,(H,17,19)(H,18,20)
InChIKeyOCYRQGAQRIRTHS-UHFFFAOYSA-N
MW286.33 g/mol
LogP2.27
Rot. Bonds4

About N'-[1-(furan-2-yl)propan-2-yl]-N-(2-methylphenyl)oxamide

N'-[1-(furan-2-yl)propan-2-yl]-N-(2-methylphenyl)oxamide (PubChem CID 121084178) has the molecular formula C16H18N2O3 and a molecular weight of 286.33 g/mol. Its IUPAC name is N'-[1-(furan-2-yl)propan-2-yl]-N-(2-methylphenyl)oxamide.

Molecular Properties

Compound NameN'-[1-(furan-2-yl)propan-2-yl]-N-(2-methylphenyl)oxamide
PubChem CID121084178
Molecular FormulaC16H18N2O3
Molecular Weight286.33 g/mol
Exact Mass286.13
IUPAC NameN'-[1-(furan-2-yl)propan-2-yl]-N-(2-methylphenyl)oxamide
SMILESCc1ccccc1NC(=O)C(=O)NC(C)Cc1ccco1
InChIInChI=1S/C16H18N2O3/c1-11-6-3-4-8-14(11)18-16(20)15(19)17-12(2)10-13-7-5-9-21-13/h3-9,12H,10H2,1-2H3,(H,17,19)(H,18,20)
InChIKeyOCYRQGAQRIRTHS-UHFFFAOYSA-N
XLogP2.27
TPSA71.34 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.33
LogP ≤ 52.27
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'-tert-butyl-N-[1-(furan-2-yl)propan-2-yl]oxamide
CID 121084172
N-(5-chloro-2-methoxyphenyl)-N'-[1-(furan-2-yl)propan-2-yl]oxamide
CID 121084227
N-[1-(furan-2-yl)propan-2-yl]benzamide
CID 47148390
N-[1-(furan-2-yl)propan-2-yl]-2-(2-methylphenoxy)acetamide
CID 47168840
2-anilino-N-[1-(furan-2-yl)propan-2-yl]acetamide
CID 60861599
N-cycloheptyl-N'-[1-(furan-2-yl)propan-2-yl]oxamide
CID 121084182
(E)-N-[(2R)-1-(furan-2-yl)propan-2-yl]-2-methylpent-2-enamide
CID 98205277
2-bromo-N-[1-(furan-2-yl)propan-2-yl]-3-methylbenzamide
CID 113338814
2-(ethylamino)-N-[1-(furan-2-yl)propan-2-yl]benzamide
CID 62179091
3-chloro-N-[1-(furan-2-yl)propan-2-yl]-2-methylpropanamide
CID 62728492
(2R)-N-[(2R)-1-(furan-2-yl)propan-2-yl]-2-methylsulfonylpropanamide
CID 94171682
N-[1-(furan-2-yl)propan-2-yl]-2-phenoxyacetamide
CID 47148392

Frequently Asked Questions

What is the IUPAC name of N'-[1-(furan-2-yl)propan-2-yl]-N-(2-methylphenyl)oxamide?
The IUPAC name of N'-[1-(furan-2-yl)propan-2-yl]-N-(2-methylphenyl)oxamide (CID 121084178) is N'-[1-(furan-2-yl)propan-2-yl]-N-(2-methylphenyl)oxamide.
What is the SMILES notation for N'-[1-(furan-2-yl)propan-2-yl]-N-(2-methylphenyl)oxamide?
The canonical SMILES for N'-[1-(furan-2-yl)propan-2-yl]-N-(2-methylphenyl)oxamide is Cc1ccccc1NC(=O)C(=O)NC(C)Cc1ccco1.
What is the InChIKey of N'-[1-(furan-2-yl)propan-2-yl]-N-(2-methylphenyl)oxamide?
The InChIKey is OCYRQGAQRIRTHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O3/c1-11-6-3-4-8-14(11)18-16(20)15(19)17-12(2)10-13-7-5-9-21-13/h3-9,12H,10H2,1-2H3,(H,17,19)(H,18,20).
What are the key properties of N'-[1-(furan-2-yl)propan-2-yl]-N-(2-methylphenyl)oxamide?
N'-[1-(furan-2-yl)propan-2-yl]-N-(2-methylphenyl)oxamide has a molecular weight of 286.33 g/mol, XLogP of 2.27, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[1-(furan-2-yl)propan-2-yl]-N-(2-methylphenyl)oxamide is sourced from PubChem (CID 121084178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).