N,N-diethyl-3-(furan-2-yl)-3-hydrazinylpropan-1-amine

C11H21N3O — CID 105243941

IUPACN,N-diethyl-3-(furan-2-yl)-3-hydrazinylpropan-1-amine
SMILESCCN(CC)CCC(NN)c1ccco1
InChIInChI=1S/C11H21N3O/c1-3-14(4-2)8-7-10(13-12)11-6-5-9-15-11/h5-6,9-10,13H,3-4,7-8,12H2,1-2H3
InChIKeyQUOMPPXFTKWLKL-UHFFFAOYSA-N
MW211.31 g/mol
LogP1.52
Rot. Bonds7

About N,N-diethyl-3-(furan-2-yl)-3-hydrazinylpropan-1-amine

N,N-diethyl-3-(furan-2-yl)-3-hydrazinylpropan-1-amine (PubChem CID 105243941) has the molecular formula C11H21N3O and a molecular weight of 211.31 g/mol. Its IUPAC name is N,N-diethyl-3-(furan-2-yl)-3-hydrazinylpropan-1-amine.

Molecular Properties

Compound NameN,N-diethyl-3-(furan-2-yl)-3-hydrazinylpropan-1-amine
PubChem CID105243941
Molecular FormulaC11H21N3O
Molecular Weight211.31 g/mol
Exact Mass211.17
IUPAC NameN,N-diethyl-3-(furan-2-yl)-3-hydrazinylpropan-1-amine
SMILESCCN(CC)CCC(NN)c1ccco1
InChIInChI=1S/C11H21N3O/c1-3-14(4-2)8-7-10(13-12)11-6-5-9-15-11/h5-6,9-10,13H,3-4,7-8,12H2,1-2H3
InChIKeyQUOMPPXFTKWLKL-UHFFFAOYSA-N
XLogP1.52
TPSA54.43 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.31
LogP ≤ 51.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-3-(furan-2-yl)-3-hydrazinylpropan-1-amine?
The IUPAC name of N,N-diethyl-3-(furan-2-yl)-3-hydrazinylpropan-1-amine (CID 105243941) is N,N-diethyl-3-(furan-2-yl)-3-hydrazinylpropan-1-amine.
What is the SMILES notation for N,N-diethyl-3-(furan-2-yl)-3-hydrazinylpropan-1-amine?
The canonical SMILES for N,N-diethyl-3-(furan-2-yl)-3-hydrazinylpropan-1-amine is CCN(CC)CCC(NN)c1ccco1.
What is the InChIKey of N,N-diethyl-3-(furan-2-yl)-3-hydrazinylpropan-1-amine?
The InChIKey is QUOMPPXFTKWLKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3O/c1-3-14(4-2)8-7-10(13-12)11-6-5-9-15-11/h5-6,9-10,13H,3-4,7-8,12H2,1-2H3.
What are the key properties of N,N-diethyl-3-(furan-2-yl)-3-hydrazinylpropan-1-amine?
N,N-diethyl-3-(furan-2-yl)-3-hydrazinylpropan-1-amine has a molecular weight of 211.31 g/mol, XLogP of 1.52, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-3-(furan-2-yl)-3-hydrazinylpropan-1-amine is sourced from PubChem (CID 105243941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).