1-(2,5-dihydrofuran-2-yl)-N-methylmethanamine

C6H11NO — CID 89285095

IUPAC1-(2,5-dihydrofuran-2-yl)-N-methylmethanamine
SMILESCNCC1C=CCO1
InChIInChI=1S/C6H11NO/c1-7-5-6-3-2-4-8-6/h2-3,6-7H,4-5H2,1H3
InChIKeyWHQQCLXRDJWTAV-UHFFFAOYSA-N
MW113.16 g/mol
LogP0.16
Rot. Bonds2

About 1-(2,5-dihydrofuran-2-yl)-N-methylmethanamine

1-(2,5-dihydrofuran-2-yl)-N-methylmethanamine (PubChem CID 89285095) has the molecular formula C6H11NO and a molecular weight of 113.16 g/mol. Its IUPAC name is 1-(2,5-dihydrofuran-2-yl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(2,5-dihydrofuran-2-yl)-N-methylmethanamine
PubChem CID89285095
Molecular FormulaC6H11NO
Molecular Weight113.16 g/mol
Exact Mass113.08
IUPAC Name1-(2,5-dihydrofuran-2-yl)-N-methylmethanamine
SMILESCNCC1C=CCO1
InChIInChI=1S/C6H11NO/c1-7-5-6-3-2-4-8-6/h2-3,6-7H,4-5H2,1H3
InChIKeyWHQQCLXRDJWTAV-UHFFFAOYSA-N
XLogP0.16
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500113.16
LogP ≤ 50.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-(2,5-dihydrofuran-2-yl)-N-methylmethanamine?
The IUPAC name of 1-(2,5-dihydrofuran-2-yl)-N-methylmethanamine (CID 89285095) is 1-(2,5-dihydrofuran-2-yl)-N-methylmethanamine.
What is the SMILES notation for 1-(2,5-dihydrofuran-2-yl)-N-methylmethanamine?
The canonical SMILES for 1-(2,5-dihydrofuran-2-yl)-N-methylmethanamine is CNCC1C=CCO1.
What is the InChIKey of 1-(2,5-dihydrofuran-2-yl)-N-methylmethanamine?
The InChIKey is WHQQCLXRDJWTAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11NO/c1-7-5-6-3-2-4-8-6/h2-3,6-7H,4-5H2,1H3.
What are the key properties of 1-(2,5-dihydrofuran-2-yl)-N-methylmethanamine?
1-(2,5-dihydrofuran-2-yl)-N-methylmethanamine has a molecular weight of 113.16 g/mol, XLogP of 0.16, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,5-dihydrofuran-2-yl)-N-methylmethanamine is sourced from PubChem (CID 89285095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).