N'-ethyl-2-methylfuran-3-carboximidamide

C8H12N2O — CID 104790920

IUPACN'-ethyl-2-methylfuran-3-carboximidamide
SMILESCC/N=C(\N)c1ccoc1C
InChIInChI=1S/C8H12N2O/c1-3-10-8(9)7-4-5-11-6(7)2/h4-5H,3H2,1-2H3,(H2,9,10)
InChIKeyMPJZCUDNXFQDLF-UHFFFAOYSA-N
MW152.20 g/mol
LogP1.31
Rot. Bonds2

About N'-ethyl-2-methylfuran-3-carboximidamide

N'-ethyl-2-methylfuran-3-carboximidamide (PubChem CID 104790920) has the molecular formula C8H12N2O and a molecular weight of 152.20 g/mol. Its IUPAC name is N'-ethyl-2-methylfuran-3-carboximidamide.

Molecular Properties

Compound NameN'-ethyl-2-methylfuran-3-carboximidamide
PubChem CID104790920
Molecular FormulaC8H12N2O
Molecular Weight152.20 g/mol
Exact Mass152.09
IUPAC NameN'-ethyl-2-methylfuran-3-carboximidamide
SMILESCC/N=C(\N)c1ccoc1C
InChIInChI=1S/C8H12N2O/c1-3-10-8(9)7-4-5-11-6(7)2/h4-5H,3H2,1-2H3,(H2,9,10)
InChIKeyMPJZCUDNXFQDLF-UHFFFAOYSA-N
XLogP1.31
TPSA51.52 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.20
LogP ≤ 51.31
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'-ethyl-2-methylfuran-3-carboximidamide?
The IUPAC name of N'-ethyl-2-methylfuran-3-carboximidamide (CID 104790920) is N'-ethyl-2-methylfuran-3-carboximidamide.
What is the SMILES notation for N'-ethyl-2-methylfuran-3-carboximidamide?
The canonical SMILES for N'-ethyl-2-methylfuran-3-carboximidamide is CC/N=C(\N)c1ccoc1C.
What is the InChIKey of N'-ethyl-2-methylfuran-3-carboximidamide?
The InChIKey is MPJZCUDNXFQDLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2O/c1-3-10-8(9)7-4-5-11-6(7)2/h4-5H,3H2,1-2H3,(H2,9,10).
What are the key properties of N'-ethyl-2-methylfuran-3-carboximidamide?
N'-ethyl-2-methylfuran-3-carboximidamide has a molecular weight of 152.20 g/mol, XLogP of 1.31, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-ethyl-2-methylfuran-3-carboximidamide is sourced from PubChem (CID 104790920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).