N-[(E)-furan-2-ylmethylideneamino]-N-methylmethanamine

C7H10N2O — CID 5324609

IUPACN-[(E)-furan-2-ylmethylideneamino]-N-methylmethanamine
SMILESCN(C)/N=C/c1ccco1
InChIInChI=1S/C7H10N2O/c1-9(2)8-6-7-4-3-5-10-7/h3-6H,1-2H3/b8-6+
InChIKeyDURWBNUASAZMSN-SOFGYWHQSA-N
MW138.17 g/mol
LogP1.18
Rot. Bonds2

About N-[(E)-furan-2-ylmethylideneamino]-N-methylmethanamine

N-[(E)-furan-2-ylmethylideneamino]-N-methylmethanamine (PubChem CID 5324609) has the molecular formula C7H10N2O and a molecular weight of 138.17 g/mol. Its IUPAC name is N-[(E)-furan-2-ylmethylideneamino]-N-methylmethanamine.

Molecular Properties

Compound NameN-[(E)-furan-2-ylmethylideneamino]-N-methylmethanamine
PubChem CID5324609
Molecular FormulaC7H10N2O
Molecular Weight138.17 g/mol
Exact Mass138.08
IUPAC NameN-[(E)-furan-2-ylmethylideneamino]-N-methylmethanamine
SMILESCN(C)/N=C/c1ccco1
InChIInChI=1S/C7H10N2O/c1-9(2)8-6-7-4-3-5-10-7/h3-6H,1-2H3/b8-6+
InChIKeyDURWBNUASAZMSN-SOFGYWHQSA-N
XLogP1.18
TPSA28.74 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.17
LogP ≤ 51.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', '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 N-[(E)-furan-2-ylmethylideneamino]-N-methylmethanamine?
The IUPAC name of N-[(E)-furan-2-ylmethylideneamino]-N-methylmethanamine (CID 5324609) is N-[(E)-furan-2-ylmethylideneamino]-N-methylmethanamine.
What is the SMILES notation for N-[(E)-furan-2-ylmethylideneamino]-N-methylmethanamine?
The canonical SMILES for N-[(E)-furan-2-ylmethylideneamino]-N-methylmethanamine is CN(C)/N=C/c1ccco1.
What is the InChIKey of N-[(E)-furan-2-ylmethylideneamino]-N-methylmethanamine?
The InChIKey is DURWBNUASAZMSN-SOFGYWHQSA-N. The full InChI is InChI=1S/C7H10N2O/c1-9(2)8-6-7-4-3-5-10-7/h3-6H,1-2H3/b8-6+.
What are the key properties of N-[(E)-furan-2-ylmethylideneamino]-N-methylmethanamine?
N-[(E)-furan-2-ylmethylideneamino]-N-methylmethanamine has a molecular weight of 138.17 g/mol, XLogP of 1.18, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(E)-furan-2-ylmethylideneamino]-N-methylmethanamine is sourced from PubChem (CID 5324609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).