N',3-dimethylfuran-2-carboximidamide

C7H10N2O — CID 104807504

IUPACN',3-dimethylfuran-2-carboximidamide
SMILESC/N=C(\N)c1occc1C
InChIInChI=1S/C7H10N2O/c1-5-3-4-10-6(5)7(8)9-2/h3-4H,1-2H3,(H2,8,9)
InChIKeyANRQUEOXBYACQZ-UHFFFAOYSA-N
MW138.17 g/mol
LogP0.92
Rot. Bonds1

About N',3-dimethylfuran-2-carboximidamide

N',3-dimethylfuran-2-carboximidamide (PubChem CID 104807504) has the molecular formula C7H10N2O and a molecular weight of 138.17 g/mol. Its IUPAC name is N',3-dimethylfuran-2-carboximidamide.

Molecular Properties

Compound NameN',3-dimethylfuran-2-carboximidamide
PubChem CID104807504
Molecular FormulaC7H10N2O
Molecular Weight138.17 g/mol
Exact Mass138.08
IUPAC NameN',3-dimethylfuran-2-carboximidamide
SMILESC/N=C(\N)c1occc1C
InChIInChI=1S/C7H10N2O/c1-5-3-4-10-6(5)7(8)9-2/h3-4H,1-2H3,(H2,8,9)
InChIKeyANRQUEOXBYACQZ-UHFFFAOYSA-N
XLogP0.92
TPSA51.52 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.17
LogP ≤ 50.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N',3-dimethylfuran-2-carboximidamide?
The IUPAC name of N',3-dimethylfuran-2-carboximidamide (CID 104807504) is N',3-dimethylfuran-2-carboximidamide.
What is the SMILES notation for N',3-dimethylfuran-2-carboximidamide?
The canonical SMILES for N',3-dimethylfuran-2-carboximidamide is C/N=C(\N)c1occc1C.
What is the InChIKey of N',3-dimethylfuran-2-carboximidamide?
The InChIKey is ANRQUEOXBYACQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2O/c1-5-3-4-10-6(5)7(8)9-2/h3-4H,1-2H3,(H2,8,9).
What are the key properties of N',3-dimethylfuran-2-carboximidamide?
N',3-dimethylfuran-2-carboximidamide has a molecular weight of 138.17 g/mol, XLogP of 0.92, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N',3-dimethylfuran-2-carboximidamide is sourced from PubChem (CID 104807504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).