3-N,4-N-dimethylfuran-3,4-diamine

C6H10N2O — CID 21099945

IUPAC3-N,4-N-dimethylfuran-3,4-diamine
SMILESCNc1cocc1NC
InChIInChI=1S/C6H10N2O/c1-7-5-3-9-4-6(5)8-2/h3-4,7-8H,1-2H3
InChIKeyUGPPNFFLCRAZEG-UHFFFAOYSA-N
MW126.16 g/mol
LogP1.36
Rot. Bonds2

About 3-N,4-N-dimethylfuran-3,4-diamine

3-N,4-N-dimethylfuran-3,4-diamine (PubChem CID 21099945) has the molecular formula C6H10N2O and a molecular weight of 126.16 g/mol. Its IUPAC name is 3-N,4-N-dimethylfuran-3,4-diamine.

Molecular Properties

Compound Name3-N,4-N-dimethylfuran-3,4-diamine
PubChem CID21099945
Molecular FormulaC6H10N2O
Molecular Weight126.16 g/mol
Exact Mass126.08
IUPAC Name3-N,4-N-dimethylfuran-3,4-diamine
SMILESCNc1cocc1NC
InChIInChI=1S/C6H10N2O/c1-7-5-3-9-4-6(5)8-2/h3-4,7-8H,1-2H3
InChIKeyUGPPNFFLCRAZEG-UHFFFAOYSA-N
XLogP1.36
TPSA37.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.16
LogP ≤ 51.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-N,4-N-dimethylfuran-3,4-diamine?
The IUPAC name of 3-N,4-N-dimethylfuran-3,4-diamine (CID 21099945) is 3-N,4-N-dimethylfuran-3,4-diamine.
What is the SMILES notation for 3-N,4-N-dimethylfuran-3,4-diamine?
The canonical SMILES for 3-N,4-N-dimethylfuran-3,4-diamine is CNc1cocc1NC.
What is the InChIKey of 3-N,4-N-dimethylfuran-3,4-diamine?
The InChIKey is UGPPNFFLCRAZEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N2O/c1-7-5-3-9-4-6(5)8-2/h3-4,7-8H,1-2H3.
What are the key properties of 3-N,4-N-dimethylfuran-3,4-diamine?
3-N,4-N-dimethylfuran-3,4-diamine has a molecular weight of 126.16 g/mol, XLogP of 1.36, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-N,4-N-dimethylfuran-3,4-diamine is sourced from PubChem (CID 21099945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).