N,N-diethyl-2,5-dimethylfuran-3-carboxamide

C11H17NO2 — CID 39949861

IUPACN,N-diethyl-2,5-dimethylfuran-3-carboxamide
SMILESCCN(CC)C(=O)c1cc(C)oc1C
InChIInChI=1S/C11H17NO2/c1-5-12(6-2)11(13)10-7-8(3)14-9(10)4/h7H,5-6H2,1-4H3
InChIKeySIDOLLMOSSHQGR-UHFFFAOYSA-N
MW195.26 g/mol
LogP2.38
Rot. Bonds3

About N,N-diethyl-2,5-dimethylfuran-3-carboxamide

N,N-diethyl-2,5-dimethylfuran-3-carboxamide (PubChem CID 39949861) has the molecular formula C11H17NO2 and a molecular weight of 195.26 g/mol. Its IUPAC name is N,N-diethyl-2,5-dimethylfuran-3-carboxamide.

Molecular Properties

Compound NameN,N-diethyl-2,5-dimethylfuran-3-carboxamide
PubChem CID39949861
Molecular FormulaC11H17NO2
Molecular Weight195.26 g/mol
Exact Mass195.13
IUPAC NameN,N-diethyl-2,5-dimethylfuran-3-carboxamide
SMILESCCN(CC)C(=O)c1cc(C)oc1C
InChIInChI=1S/C11H17NO2/c1-5-12(6-2)11(13)10-7-8(3)14-9(10)4/h7H,5-6H2,1-4H3
InChIKeySIDOLLMOSSHQGR-UHFFFAOYSA-N
XLogP2.38
TPSA33.45 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.26
LogP ≤ 52.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze N,N-diethyl-2,5-dimethylfuran-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-2,5-dimethylfuran-3-carboxamide?
The IUPAC name of N,N-diethyl-2,5-dimethylfuran-3-carboxamide (CID 39949861) is N,N-diethyl-2,5-dimethylfuran-3-carboxamide.
What is the SMILES notation for N,N-diethyl-2,5-dimethylfuran-3-carboxamide?
The canonical SMILES for N,N-diethyl-2,5-dimethylfuran-3-carboxamide is CCN(CC)C(=O)c1cc(C)oc1C.
What is the InChIKey of N,N-diethyl-2,5-dimethylfuran-3-carboxamide?
The InChIKey is SIDOLLMOSSHQGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO2/c1-5-12(6-2)11(13)10-7-8(3)14-9(10)4/h7H,5-6H2,1-4H3.
What are the key properties of N,N-diethyl-2,5-dimethylfuran-3-carboxamide?
N,N-diethyl-2,5-dimethylfuran-3-carboxamide has a molecular weight of 195.26 g/mol, XLogP of 2.38, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-2,5-dimethylfuran-3-carboxamide is sourced from PubChem (CID 39949861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).