4-amino-N,N-diethyl-2-(furan-2-yl)butanamide

C12H20N2O2 — CID 112515361

IUPAC4-amino-N,N-diethyl-2-(furan-2-yl)butanamide
SMILESCCN(CC)C(=O)C(CCN)c1ccco1
InChIInChI=1S/C12H20N2O2/c1-3-14(4-2)12(15)10(7-8-13)11-6-5-9-16-11/h5-6,9-10H,3-4,7-8,13H2,1-2H3
InChIKeyZURCYZBECYPKDO-UHFFFAOYSA-N
MW224.30 g/mol
LogP1.58
Rot. Bonds6

About 4-amino-N,N-diethyl-2-(furan-2-yl)butanamide

4-amino-N,N-diethyl-2-(furan-2-yl)butanamide (PubChem CID 112515361) has the molecular formula C12H20N2O2 and a molecular weight of 224.30 g/mol. Its IUPAC name is 4-amino-N,N-diethyl-2-(furan-2-yl)butanamide.

Molecular Properties

Compound Name4-amino-N,N-diethyl-2-(furan-2-yl)butanamide
PubChem CID112515361
Molecular FormulaC12H20N2O2
Molecular Weight224.30 g/mol
Exact Mass224.15
IUPAC Name4-amino-N,N-diethyl-2-(furan-2-yl)butanamide
SMILESCCN(CC)C(=O)C(CCN)c1ccco1
InChIInChI=1S/C12H20N2O2/c1-3-14(4-2)12(15)10(7-8-13)11-6-5-9-16-11/h5-6,9-10H,3-4,7-8,13H2,1-2H3
InChIKeyZURCYZBECYPKDO-UHFFFAOYSA-N
XLogP1.58
TPSA59.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.30
LogP ≤ 51.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-amino-2-(2-chlorophenyl)-N,N-diethylbutanamide
CID 112517449
3-amino-N,N-diethyl-2-phenylpropanamide
CID 62876932
N-(2-aminoethyl)-N-ethylfuran-2-carboxamide
CID 28707635
(2R)-2-amino-N-ethyl-N-(furan-2-ylmethyl)pentanamide
CID 107568950
N,N-diethyl-2-[1-(furan-2-yl)ethylamino]acetamide
CID 43401823
(3S)-N,N-diethyl-2,2-difluoro-3-(furan-2-yl)-3-hydroxypropanamide
CID 70229752
(2S,3S)-N,N-diethyl-2-fluoro-3-(furan-2-yl)-3-hydroxy-2-methylpropanamide
CID 10955771
(2S)-2-amino-N-ethyl-N-(furan-2-ylmethyl)hexanamide
CID 113357146
3-amino-3-(furan-2-yl)-N,N-dimethylpropanamide
CID 82075111
N-ethyl-N-(furan-2-ylmethyl)-2-sulfanylpropanamide
CID 107024393
propan-2-yl N-ethyl-N-(furan-2-ylmethyl)carbamate
CID 116654523
N-(1-aminopentan-3-yl)furan-2-carboxamide
CID 62653791

Frequently Asked Questions

What is the IUPAC name of 4-amino-N,N-diethyl-2-(furan-2-yl)butanamide?
The IUPAC name of 4-amino-N,N-diethyl-2-(furan-2-yl)butanamide (CID 112515361) is 4-amino-N,N-diethyl-2-(furan-2-yl)butanamide.
What is the SMILES notation for 4-amino-N,N-diethyl-2-(furan-2-yl)butanamide?
The canonical SMILES for 4-amino-N,N-diethyl-2-(furan-2-yl)butanamide is CCN(CC)C(=O)C(CCN)c1ccco1.
What is the InChIKey of 4-amino-N,N-diethyl-2-(furan-2-yl)butanamide?
The InChIKey is ZURCYZBECYPKDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O2/c1-3-14(4-2)12(15)10(7-8-13)11-6-5-9-16-11/h5-6,9-10H,3-4,7-8,13H2,1-2H3.
What are the key properties of 4-amino-N,N-diethyl-2-(furan-2-yl)butanamide?
4-amino-N,N-diethyl-2-(furan-2-yl)butanamide has a molecular weight of 224.30 g/mol, XLogP of 1.58, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N,N-diethyl-2-(furan-2-yl)butanamide is sourced from PubChem (CID 112515361), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).