N'-[2-(dimethylamino)ethyl]-N-[2-(furan-3-yl)ethyl]oxamide

C12H19N3O3 — CID 90558523

IUPACN'-[2-(dimethylamino)ethyl]-N-[2-(furan-3-yl)ethyl]oxamide
SMILESCN(C)CCNC(=O)C(=O)NCCc1ccoc1
InChIInChI=1S/C12H19N3O3/c1-15(2)7-6-14-12(17)11(16)13-5-3-10-4-8-18-9-10/h4,8-9H,3,5-7H2,1-2H3,(H,13,16)(H,14,17)
InChIKeyHYAZRSZVUZONPP-UHFFFAOYSA-N
MW253.30 g/mol
LogP-0.38
Rot. Bonds6

About N'-[2-(dimethylamino)ethyl]-N-[2-(furan-3-yl)ethyl]oxamide

N'-[2-(dimethylamino)ethyl]-N-[2-(furan-3-yl)ethyl]oxamide (PubChem CID 90558523) has the molecular formula C12H19N3O3 and a molecular weight of 253.30 g/mol. Its IUPAC name is N'-[2-(dimethylamino)ethyl]-N-[2-(furan-3-yl)ethyl]oxamide.

Molecular Properties

Compound NameN'-[2-(dimethylamino)ethyl]-N-[2-(furan-3-yl)ethyl]oxamide
PubChem CID90558523
Molecular FormulaC12H19N3O3
Molecular Weight253.30 g/mol
Exact Mass253.14
IUPAC NameN'-[2-(dimethylamino)ethyl]-N-[2-(furan-3-yl)ethyl]oxamide
SMILESCN(C)CCNC(=O)C(=O)NCCc1ccoc1
InChIInChI=1S/C12H19N3O3/c1-15(2)7-6-14-12(17)11(16)13-5-3-10-4-8-18-9-10/h4,8-9H,3,5-7H2,1-2H3,(H,13,16)(H,14,17)
InChIKeyHYAZRSZVUZONPP-UHFFFAOYSA-N
XLogP-0.38
TPSA74.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.30
LogP ≤ 5-0.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-[2-(furan-3-yl)ethyl]-N'-[(4-methoxyphenyl)methyl]oxamide
CID 90558497
N'-[2-(dimethylamino)ethyl]-N-[2-(4-methoxyphenyl)ethyl]oxamide
CID 44996184
N-[2-(furan-3-yl)ethyl]-2-methoxyacetamide
CID 90558235
1-[2-(furan-3-yl)ethyl]-3-(2-methoxyethyl)urea
CID 71798548
N-[2-(furan-3-yl)ethyl]-N'-[4-(trifluoromethyl)phenyl]oxamide
CID 90558521
N'-(2,5-difluorophenyl)-N-[2-(furan-3-yl)ethyl]oxamide
CID 90558490
N-[2-(furan-3-yl)ethyl]-2,5-dimethylfuran-3-carboxamide
CID 90558255
cis-(1R,3S)-3-[2-(furan-3-yl)ethylcarbamoyl]-2,2-dimethylcyclopropane-1-carboxylic acid
CID 166242258
2-(4-ethoxyphenoxy)-N-[2-(furan-3-yl)ethyl]acetamide
CID 90558332
N-[2-(furan-3-yl)ethyl]-5-methyl-1,2-oxazole-3-carboxamide
CID 71798432
1-(4-tert-butylphenyl)-3-[2-(furan-3-yl)ethyl]urea
CID 90558553
(E)-3-(furan-3-yl)-N-[2-(furan-3-yl)ethyl]prop-2-enamide
CID 71807047

Frequently Asked Questions

What is the IUPAC name of N'-[2-(dimethylamino)ethyl]-N-[2-(furan-3-yl)ethyl]oxamide?
The IUPAC name of N'-[2-(dimethylamino)ethyl]-N-[2-(furan-3-yl)ethyl]oxamide (CID 90558523) is N'-[2-(dimethylamino)ethyl]-N-[2-(furan-3-yl)ethyl]oxamide.
What is the SMILES notation for N'-[2-(dimethylamino)ethyl]-N-[2-(furan-3-yl)ethyl]oxamide?
The canonical SMILES for N'-[2-(dimethylamino)ethyl]-N-[2-(furan-3-yl)ethyl]oxamide is CN(C)CCNC(=O)C(=O)NCCc1ccoc1.
What is the InChIKey of N'-[2-(dimethylamino)ethyl]-N-[2-(furan-3-yl)ethyl]oxamide?
The InChIKey is HYAZRSZVUZONPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O3/c1-15(2)7-6-14-12(17)11(16)13-5-3-10-4-8-18-9-10/h4,8-9H,3,5-7H2,1-2H3,(H,13,16)(H,14,17).
What are the key properties of N'-[2-(dimethylamino)ethyl]-N-[2-(furan-3-yl)ethyl]oxamide?
N'-[2-(dimethylamino)ethyl]-N-[2-(furan-3-yl)ethyl]oxamide has a molecular weight of 253.30 g/mol, XLogP of -0.38, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[2-(dimethylamino)ethyl]-N-[2-(furan-3-yl)ethyl]oxamide is sourced from PubChem (CID 90558523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).