N-ethyl-N,2,4-trimethylfuran-3-carboxamide

C10H15NO2 — CID 131084548

IUPACN-ethyl-N,2,4-trimethylfuran-3-carboxamide
SMILESCCN(C)C(=O)c1c(C)coc1C
InChIInChI=1S/C10H15NO2/c1-5-11(4)10(12)9-7(2)6-13-8(9)3/h6H,5H2,1-4H3
InChIKeyHHKWXSCVSKZOPN-UHFFFAOYSA-N
MW181.23 g/mol
LogP1.99
Rot. Bonds2

About N-ethyl-N,2,4-trimethylfuran-3-carboxamide

N-ethyl-N,2,4-trimethylfuran-3-carboxamide (PubChem CID 131084548) has the molecular formula C10H15NO2 and a molecular weight of 181.23 g/mol. Its IUPAC name is N-ethyl-N,2,4-trimethylfuran-3-carboxamide.

Molecular Properties

Compound NameN-ethyl-N,2,4-trimethylfuran-3-carboxamide
PubChem CID131084548
Molecular FormulaC10H15NO2
Molecular Weight181.23 g/mol
Exact Mass181.11
IUPAC NameN-ethyl-N,2,4-trimethylfuran-3-carboxamide
SMILESCCN(C)C(=O)c1c(C)coc1C
InChIInChI=1S/C10H15NO2/c1-5-11(4)10(12)9-7(2)6-13-8(9)3/h6H,5H2,1-4H3
InChIKeyHHKWXSCVSKZOPN-UHFFFAOYSA-N
XLogP1.99
TPSA33.45 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.23
LogP ≤ 51.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-N,2,4-trimethylfuran-3-carboxamide?
The IUPAC name of N-ethyl-N,2,4-trimethylfuran-3-carboxamide (CID 131084548) is N-ethyl-N,2,4-trimethylfuran-3-carboxamide.
What is the SMILES notation for N-ethyl-N,2,4-trimethylfuran-3-carboxamide?
The canonical SMILES for N-ethyl-N,2,4-trimethylfuran-3-carboxamide is CCN(C)C(=O)c1c(C)coc1C.
What is the InChIKey of N-ethyl-N,2,4-trimethylfuran-3-carboxamide?
The InChIKey is HHKWXSCVSKZOPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO2/c1-5-11(4)10(12)9-7(2)6-13-8(9)3/h6H,5H2,1-4H3.
What are the key properties of N-ethyl-N,2,4-trimethylfuran-3-carboxamide?
N-ethyl-N,2,4-trimethylfuran-3-carboxamide has a molecular weight of 181.23 g/mol, XLogP of 1.99, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N,2,4-trimethylfuran-3-carboxamide is sourced from PubChem (CID 131084548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).