N-ethyl-N,3,4,7-tetramethyl-1-benzofuran-2-carboxamide

C15H19NO2 — CID 60578508

IUPACN-ethyl-N,3,4,7-tetramethyl-1-benzofuran-2-carboxamide
SMILESCCN(C)C(=O)c1oc2c(C)ccc(C)c2c1C
InChIInChI=1S/C15H19NO2/c1-6-16(5)15(17)14-11(4)12-9(2)7-8-10(3)13(12)18-14/h7-8H,6H2,1-5H3
InChIKeyQWZKCHYDFZGMCW-UHFFFAOYSA-N
MW245.32 g/mol
LogP3.45
Rot. Bonds2

About N-ethyl-N,3,4,7-tetramethyl-1-benzofuran-2-carboxamide

N-ethyl-N,3,4,7-tetramethyl-1-benzofuran-2-carboxamide (PubChem CID 60578508) has the molecular formula C15H19NO2 and a molecular weight of 245.32 g/mol. Its IUPAC name is N-ethyl-N,3,4,7-tetramethyl-1-benzofuran-2-carboxamide.

Molecular Properties

Compound NameN-ethyl-N,3,4,7-tetramethyl-1-benzofuran-2-carboxamide
PubChem CID60578508
Molecular FormulaC15H19NO2
Molecular Weight245.32 g/mol
Exact Mass245.14
IUPAC NameN-ethyl-N,3,4,7-tetramethyl-1-benzofuran-2-carboxamide
SMILESCCN(C)C(=O)c1oc2c(C)ccc(C)c2c1C
InChIInChI=1S/C15H19NO2/c1-6-16(5)15(17)14-11(4)12-9(2)7-8-10(3)13(12)18-14/h7-8H,6H2,1-5H3
InChIKeyQWZKCHYDFZGMCW-UHFFFAOYSA-N
XLogP3.45
TPSA33.45 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.32
LogP ≤ 53.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-N,3,4,7-tetramethyl-1-benzofuran-2-carboxamide?
The IUPAC name of N-ethyl-N,3,4,7-tetramethyl-1-benzofuran-2-carboxamide (CID 60578508) is N-ethyl-N,3,4,7-tetramethyl-1-benzofuran-2-carboxamide.
What is the SMILES notation for N-ethyl-N,3,4,7-tetramethyl-1-benzofuran-2-carboxamide?
The canonical SMILES for N-ethyl-N,3,4,7-tetramethyl-1-benzofuran-2-carboxamide is CCN(C)C(=O)c1oc2c(C)ccc(C)c2c1C.
What is the InChIKey of N-ethyl-N,3,4,7-tetramethyl-1-benzofuran-2-carboxamide?
The InChIKey is QWZKCHYDFZGMCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NO2/c1-6-16(5)15(17)14-11(4)12-9(2)7-8-10(3)13(12)18-14/h7-8H,6H2,1-5H3.
What are the key properties of N-ethyl-N,3,4,7-tetramethyl-1-benzofuran-2-carboxamide?
N-ethyl-N,3,4,7-tetramethyl-1-benzofuran-2-carboxamide has a molecular weight of 245.32 g/mol, XLogP of 3.45, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N,3,4,7-tetramethyl-1-benzofuran-2-carboxamide is sourced from PubChem (CID 60578508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).