N'-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-N-prop-2-enyloxamide

C13H19N3O3 — CID 16875563

IUPACN'-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-N-prop-2-enyloxamide
SMILESC=CCNC(=O)C(=O)NCC(c1ccco1)N(C)C
InChIInChI=1S/C13H19N3O3/c1-4-7-14-12(17)13(18)15-9-10(16(2)3)11-6-5-8-19-11/h4-6,8,10H,1,7,9H2,2-3H3,(H,14,17)(H,15,18)
InChIKeyLYGPVNDMSNDYSZ-UHFFFAOYSA-N
MW265.31 g/mol
LogP0.30
Rot. Bonds6

About N'-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-N-prop-2-enyloxamide

N'-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-N-prop-2-enyloxamide (PubChem CID 16875563) has the molecular formula C13H19N3O3 and a molecular weight of 265.31 g/mol. Its IUPAC name is N'-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-N-prop-2-enyloxamide.

Molecular Properties

Compound NameN'-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-N-prop-2-enyloxamide
PubChem CID16875563
Molecular FormulaC13H19N3O3
Molecular Weight265.31 g/mol
Exact Mass265.14
IUPAC NameN'-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-N-prop-2-enyloxamide
SMILESC=CCNC(=O)C(=O)NCC(c1ccco1)N(C)C
InChIInChI=1S/C13H19N3O3/c1-4-7-14-12(17)13(18)15-9-10(16(2)3)11-6-5-8-19-11/h4-6,8,10H,1,7,9H2,2-3H3,(H,14,17)(H,15,18)
InChIKeyLYGPVNDMSNDYSZ-UHFFFAOYSA-N
XLogP0.30
TPSA74.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.31
LogP ≤ 50.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N'-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-N-(2-phenylethyl)oxamide
CID 16875604
N'-cyclopentyl-N-[(2R)-2-(dimethylamino)-2-(furan-2-yl)ethyl]oxamide
CID 41454031
N'-cyclopentyl-N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]oxamide
CID 18589097
1-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-3-phenylurea
CID 18588934
N'-[(2S)-2-(dimethylamino)-2-[4-(dimethylamino)phenyl]ethyl]-N-prop-2-enyloxamide
CID 7639168
(2R)-N-[(2S)-2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-methylbutanamide
CID 94606457
N-[(2R)-2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-methylbenzamide
CID 26818992
6-[[2-(dimethylamino)-2-(furan-2-yl)ethyl]amino]-6-oxohexanoic acid
CID 60933195
(E)-3-(4-chlorophenyl)-N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-methylprop-2-enamide
CID 110302146
N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-3-methylbutanamide;hydrochloride
CID 52985245
N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]benzamide;hydrochloride
CID 20994951
N'-[2-(3,5-dimethylpyrazol-1-yl)-2-(furan-2-yl)ethyl]-N-prop-2-enyloxamide
CID 122265812

Frequently Asked Questions

What is the IUPAC name of N'-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-N-prop-2-enyloxamide?
The IUPAC name of N'-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-N-prop-2-enyloxamide (CID 16875563) is N'-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-N-prop-2-enyloxamide.
What is the SMILES notation for N'-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-N-prop-2-enyloxamide?
The canonical SMILES for N'-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-N-prop-2-enyloxamide is C=CCNC(=O)C(=O)NCC(c1ccco1)N(C)C.
What is the InChIKey of N'-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-N-prop-2-enyloxamide?
The InChIKey is LYGPVNDMSNDYSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O3/c1-4-7-14-12(17)13(18)15-9-10(16(2)3)11-6-5-8-19-11/h4-6,8,10H,1,7,9H2,2-3H3,(H,14,17)(H,15,18).
What are the key properties of N'-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-N-prop-2-enyloxamide?
N'-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-N-prop-2-enyloxamide has a molecular weight of 265.31 g/mol, XLogP of 0.30, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-N-prop-2-enyloxamide is sourced from PubChem (CID 16875563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).