5-(aminomethyl)-N,N-dimethylfuran-2-amine

C7H12N2O — CID 82418188

IUPAC5-(aminomethyl)-N,N-dimethylfuran-2-amine
SMILESCN(C)c1ccc(CN)o1
InChIInChI=1S/C7H12N2O/c1-9(2)7-4-3-6(5-8)10-7/h3-4H,5,8H2,1-2H3
InChIKeySOEPOAHDGICTRQ-UHFFFAOYSA-N
MW140.19 g/mol
LogP0.80
Rot. Bonds2

About 5-(aminomethyl)-N,N-dimethylfuran-2-amine

5-(aminomethyl)-N,N-dimethylfuran-2-amine (PubChem CID 82418188) has the molecular formula C7H12N2O and a molecular weight of 140.19 g/mol. Its IUPAC name is 5-(aminomethyl)-N,N-dimethylfuran-2-amine.

Molecular Properties

Compound Name5-(aminomethyl)-N,N-dimethylfuran-2-amine
PubChem CID82418188
Molecular FormulaC7H12N2O
Molecular Weight140.19 g/mol
Exact Mass140.09
IUPAC Name5-(aminomethyl)-N,N-dimethylfuran-2-amine
SMILESCN(C)c1ccc(CN)o1
InChIInChI=1S/C7H12N2O/c1-9(2)7-4-3-6(5-8)10-7/h3-4H,5,8H2,1-2H3
InChIKeySOEPOAHDGICTRQ-UHFFFAOYSA-N
XLogP0.80
TPSA42.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.19
LogP ≤ 50.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-(aminomethyl)-N,N-dimethylfuran-2-amine?
The IUPAC name of 5-(aminomethyl)-N,N-dimethylfuran-2-amine (CID 82418188) is 5-(aminomethyl)-N,N-dimethylfuran-2-amine.
What is the SMILES notation for 5-(aminomethyl)-N,N-dimethylfuran-2-amine?
The canonical SMILES for 5-(aminomethyl)-N,N-dimethylfuran-2-amine is CN(C)c1ccc(CN)o1.
What is the InChIKey of 5-(aminomethyl)-N,N-dimethylfuran-2-amine?
The InChIKey is SOEPOAHDGICTRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N2O/c1-9(2)7-4-3-6(5-8)10-7/h3-4H,5,8H2,1-2H3.
What are the key properties of 5-(aminomethyl)-N,N-dimethylfuran-2-amine?
5-(aminomethyl)-N,N-dimethylfuran-2-amine has a molecular weight of 140.19 g/mol, XLogP of 0.80, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(aminomethyl)-N,N-dimethylfuran-2-amine is sourced from PubChem (CID 82418188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).