N,N-dimethylfuran-3-amine

C6H9NO — CID 20531373

IUPACN,N-dimethylfuran-3-amine
SMILESCN(C)c1ccoc1
InChIInChI=1S/C6H9NO/c1-7(2)6-3-4-8-5-6/h3-5H,1-2H3
InChIKeyCABYHZORCTZBOU-UHFFFAOYSA-N
MW111.14 g/mol
LogP1.35
Rot. Bonds1

About N,N-dimethylfuran-3-amine

N,N-dimethylfuran-3-amine (PubChem CID 20531373) has the molecular formula C6H9NO and a molecular weight of 111.14 g/mol. Its IUPAC name is N,N-dimethylfuran-3-amine.

Molecular Properties

Compound NameN,N-dimethylfuran-3-amine
PubChem CID20531373
Molecular FormulaC6H9NO
Molecular Weight111.14 g/mol
Exact Mass111.07
IUPAC NameN,N-dimethylfuran-3-amine
SMILESCN(C)c1ccoc1
InChIInChI=1S/C6H9NO/c1-7(2)6-3-4-8-5-6/h3-5H,1-2H3
InChIKeyCABYHZORCTZBOU-UHFFFAOYSA-N
XLogP1.35
TPSA16.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500111.14
LogP ≤ 51.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethylfuran-3-amine?
The IUPAC name of N,N-dimethylfuran-3-amine (CID 20531373) is N,N-dimethylfuran-3-amine.
What is the SMILES notation for N,N-dimethylfuran-3-amine?
The canonical SMILES for N,N-dimethylfuran-3-amine is CN(C)c1ccoc1.
What is the InChIKey of N,N-dimethylfuran-3-amine?
The InChIKey is CABYHZORCTZBOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9NO/c1-7(2)6-3-4-8-5-6/h3-5H,1-2H3.
What are the key properties of N,N-dimethylfuran-3-amine?
N,N-dimethylfuran-3-amine has a molecular weight of 111.14 g/mol, XLogP of 1.35, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethylfuran-3-amine is sourced from PubChem (CID 20531373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).