2-[1-(dimethylamino)propan-2-yl-ethylamino]-1-(furan-2-yl)ethanone

C13H22N2O2 — CID 103189899

IUPAC2-[1-(dimethylamino)propan-2-yl-ethylamino]-1-(furan-2-yl)ethanone
SMILESCCN(CC(=O)c1ccco1)C(C)CN(C)C
InChIInChI=1S/C13H22N2O2/c1-5-15(11(2)9-14(3)4)10-12(16)13-7-6-8-17-13/h6-8,11H,5,9-10H2,1-4H3
InChIKeyARIKLCTUNQBXMG-UHFFFAOYSA-N
MW238.33 g/mol
LogP1.73
Rot. Bonds7

About 2-[1-(dimethylamino)propan-2-yl-ethylamino]-1-(furan-2-yl)ethanone

2-[1-(dimethylamino)propan-2-yl-ethylamino]-1-(furan-2-yl)ethanone (PubChem CID 103189899) has the molecular formula C13H22N2O2 and a molecular weight of 238.33 g/mol. Its IUPAC name is 2-[1-(dimethylamino)propan-2-yl-ethylamino]-1-(furan-2-yl)ethanone.

Molecular Properties

Compound Name2-[1-(dimethylamino)propan-2-yl-ethylamino]-1-(furan-2-yl)ethanone
PubChem CID103189899
Molecular FormulaC13H22N2O2
Molecular Weight238.33 g/mol
Exact Mass238.17
IUPAC Name2-[1-(dimethylamino)propan-2-yl-ethylamino]-1-(furan-2-yl)ethanone
SMILESCCN(CC(=O)c1ccco1)C(C)CN(C)C
InChIInChI=1S/C13H22N2O2/c1-5-15(11(2)9-14(3)4)10-12(16)13-7-6-8-17-13/h6-8,11H,5,9-10H2,1-4H3
InChIKeyARIKLCTUNQBXMG-UHFFFAOYSA-N
XLogP1.73
TPSA36.69 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.33
LogP ≤ 51.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1-(furan-2-yl)-2-[2-methoxyethyl(1-methoxypropan-2-yl)amino]ethanone
CID 55004845
1-(1,3-benzodioxol-5-yl)-2-[1-(dimethylamino)propan-2-yl-ethylamino]ethanone
CID 103189935
1-(furan-2-yl)-2-[methyl(2,2,2-trifluoroethyl)amino]ethanone
CID 60892744
2-[[2-(furan-2-yl)-2-oxoethyl]-propylamino]-N,N-dimethylacetamide
CID 62030551
2-[cyclopentyl(ethyl)amino]-1-(furan-2-yl)ethanone
CID 43796327
1-(furan-2-yl)-4-methylpentane-1,3-dione
CID 62875308
3-[[2-(furan-2-yl)-2-oxoethyl]-(2-methylpropyl)amino]propanenitrile
CID 62052823
1-(furan-2-yl)-2-[2-hydroxyethyl(propyl)amino]ethanone
CID 62053466
N-[2-[2-hydroxypropyl(methyl)amino]-2-oxoethyl]-N-methylfuran-2-carboxamide
CID 55060862
N-[2-(diethylamino)-4-methylpentyl]furan-2-carboxamide
CID 86984929
1-(furan-2-yl)-2-(2-methylpropoxy)ethanone
CID 43798717
1-(furan-2-yl)-2-[3-methoxypropyl(methyl)amino]ethanone
CID 63008571

Frequently Asked Questions

What is the IUPAC name of 2-[1-(dimethylamino)propan-2-yl-ethylamino]-1-(furan-2-yl)ethanone?
The IUPAC name of 2-[1-(dimethylamino)propan-2-yl-ethylamino]-1-(furan-2-yl)ethanone (CID 103189899) is 2-[1-(dimethylamino)propan-2-yl-ethylamino]-1-(furan-2-yl)ethanone.
What is the SMILES notation for 2-[1-(dimethylamino)propan-2-yl-ethylamino]-1-(furan-2-yl)ethanone?
The canonical SMILES for 2-[1-(dimethylamino)propan-2-yl-ethylamino]-1-(furan-2-yl)ethanone is CCN(CC(=O)c1ccco1)C(C)CN(C)C.
What is the InChIKey of 2-[1-(dimethylamino)propan-2-yl-ethylamino]-1-(furan-2-yl)ethanone?
The InChIKey is ARIKLCTUNQBXMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2O2/c1-5-15(11(2)9-14(3)4)10-12(16)13-7-6-8-17-13/h6-8,11H,5,9-10H2,1-4H3.
What are the key properties of 2-[1-(dimethylamino)propan-2-yl-ethylamino]-1-(furan-2-yl)ethanone?
2-[1-(dimethylamino)propan-2-yl-ethylamino]-1-(furan-2-yl)ethanone has a molecular weight of 238.33 g/mol, XLogP of 1.73, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(dimethylamino)propan-2-yl-ethylamino]-1-(furan-2-yl)ethanone is sourced from PubChem (CID 103189899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).