3-(furan-3-yl)-3-hydrazinyl-N,N-dimethylpropan-1-amine

C9H17N3O — CID 105259357

IUPAC3-(furan-3-yl)-3-hydrazinyl-N,N-dimethylpropan-1-amine
SMILESCN(C)CCC(NN)c1ccoc1
InChIInChI=1S/C9H17N3O/c1-12(2)5-3-9(11-10)8-4-6-13-7-8/h4,6-7,9,11H,3,5,10H2,1-2H3
InChIKeyZMKYVQGTXIPLBG-UHFFFAOYSA-N
MW183.25 g/mol
LogP0.74
Rot. Bonds5

About 3-(furan-3-yl)-3-hydrazinyl-N,N-dimethylpropan-1-amine

3-(furan-3-yl)-3-hydrazinyl-N,N-dimethylpropan-1-amine (PubChem CID 105259357) has the molecular formula C9H17N3O and a molecular weight of 183.25 g/mol. Its IUPAC name is 3-(furan-3-yl)-3-hydrazinyl-N,N-dimethylpropan-1-amine.

Molecular Properties

Compound Name3-(furan-3-yl)-3-hydrazinyl-N,N-dimethylpropan-1-amine
PubChem CID105259357
Molecular FormulaC9H17N3O
Molecular Weight183.25 g/mol
Exact Mass183.14
IUPAC Name3-(furan-3-yl)-3-hydrazinyl-N,N-dimethylpropan-1-amine
SMILESCN(C)CCC(NN)c1ccoc1
InChIInChI=1S/C9H17N3O/c1-12(2)5-3-9(11-10)8-4-6-13-7-8/h4,6-7,9,11H,3,5,10H2,1-2H3
InChIKeyZMKYVQGTXIPLBG-UHFFFAOYSA-N
XLogP0.74
TPSA54.43 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.25
LogP ≤ 50.74
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 3-(furan-3-yl)-3-hydrazinyl-N,N-dimethylpropan-1-amine?
The IUPAC name of 3-(furan-3-yl)-3-hydrazinyl-N,N-dimethylpropan-1-amine (CID 105259357) is 3-(furan-3-yl)-3-hydrazinyl-N,N-dimethylpropan-1-amine.
What is the SMILES notation for 3-(furan-3-yl)-3-hydrazinyl-N,N-dimethylpropan-1-amine?
The canonical SMILES for 3-(furan-3-yl)-3-hydrazinyl-N,N-dimethylpropan-1-amine is CN(C)CCC(NN)c1ccoc1.
What is the InChIKey of 3-(furan-3-yl)-3-hydrazinyl-N,N-dimethylpropan-1-amine?
The InChIKey is ZMKYVQGTXIPLBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N3O/c1-12(2)5-3-9(11-10)8-4-6-13-7-8/h4,6-7,9,11H,3,5,10H2,1-2H3.
What are the key properties of 3-(furan-3-yl)-3-hydrazinyl-N,N-dimethylpropan-1-amine?
3-(furan-3-yl)-3-hydrazinyl-N,N-dimethylpropan-1-amine has a molecular weight of 183.25 g/mol, XLogP of 0.74, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(furan-3-yl)-3-hydrazinyl-N,N-dimethylpropan-1-amine is sourced from PubChem (CID 105259357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).