N-[(4-ethoxyphenyl)methyl]-N,3-dimethylfuran-2-carboxamide

C16H19NO3 — CID 134044703

IUPACN-[(4-ethoxyphenyl)methyl]-N,3-dimethylfuran-2-carboxamide
SMILESCCOc1ccc(CN(C)C(=O)c2occc2C)cc1
InChIInChI=1S/C16H19NO3/c1-4-19-14-7-5-13(6-8-14)11-17(3)16(18)15-12(2)9-10-20-15/h5-10H,4,11H2,1-3H3
InChIKeyINLDWDUTNOKWBQ-UHFFFAOYSA-N
MW273.33 g/mol
LogP3.26
Rot. Bonds5

About N-[(4-ethoxyphenyl)methyl]-N,3-dimethylfuran-2-carboxamide

N-[(4-ethoxyphenyl)methyl]-N,3-dimethylfuran-2-carboxamide (PubChem CID 134044703) has the molecular formula C16H19NO3 and a molecular weight of 273.33 g/mol. Its IUPAC name is N-[(4-ethoxyphenyl)methyl]-N,3-dimethylfuran-2-carboxamide.

Molecular Properties

Compound NameN-[(4-ethoxyphenyl)methyl]-N,3-dimethylfuran-2-carboxamide
PubChem CID134044703
Molecular FormulaC16H19NO3
Molecular Weight273.33 g/mol
Exact Mass273.14
IUPAC NameN-[(4-ethoxyphenyl)methyl]-N,3-dimethylfuran-2-carboxamide
SMILESCCOc1ccc(CN(C)C(=O)c2occc2C)cc1
InChIInChI=1S/C16H19NO3/c1-4-19-14-7-5-13(6-8-14)11-17(3)16(18)15-12(2)9-10-20-15/h5-10H,4,11H2,1-3H3
InChIKeyINLDWDUTNOKWBQ-UHFFFAOYSA-N
XLogP3.26
TPSA42.68 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.33
LogP ≤ 53.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(4-ethoxyphenyl)methyl]-N,4-dimethylbenzamide
CID 78780692
4-ethoxy-N-[(4-fluorophenyl)methyl]-N-methylbenzamide
CID 78770402
4-bromo-N-[(4-ethoxyphenyl)methyl]-N,2-dimethylbenzamide
CID 55833445
N-[(4-ethoxyphenyl)methyl]-2-ethyl-N-methylbutanamide
CID 78780749
N-[(3-chlorophenyl)methyl]-N,3-dimethylfuran-2-carboxamide
CID 134044846
N-[(4-ethoxyphenyl)methyl]-N-methyl-2,3-dihydro-1,4-benzodioxine-6-carboxamide
CID 34865342
N-[(4-ethoxyphenyl)methyl]-N-methyl-2-(2-methylphenyl)acetamide
CID 78788525
N-[(4-ethoxyphenyl)methyl]-3-(furan-2-yl)-N-methylpropanamide
CID 78779679
N,3-dimethyl-N-(2-pyridin-4-ylethyl)furan-2-carboxamide
CID 110695643
2-[(4-ethoxyphenyl)methyl-methylamino]acetic acid
CID 39245612
N-[(4-ethoxyphenyl)methyl]-N-methylbut-2-enamide
CID 78906847
N-[(4-ethoxyphenyl)methyl]-4-hydroxy-N-methylbutanamide
CID 79017080

Frequently Asked Questions

What is the IUPAC name of N-[(4-ethoxyphenyl)methyl]-N,3-dimethylfuran-2-carboxamide?
The IUPAC name of N-[(4-ethoxyphenyl)methyl]-N,3-dimethylfuran-2-carboxamide (CID 134044703) is N-[(4-ethoxyphenyl)methyl]-N,3-dimethylfuran-2-carboxamide.
What is the SMILES notation for N-[(4-ethoxyphenyl)methyl]-N,3-dimethylfuran-2-carboxamide?
The canonical SMILES for N-[(4-ethoxyphenyl)methyl]-N,3-dimethylfuran-2-carboxamide is CCOc1ccc(CN(C)C(=O)c2occc2C)cc1.
What is the InChIKey of N-[(4-ethoxyphenyl)methyl]-N,3-dimethylfuran-2-carboxamide?
The InChIKey is INLDWDUTNOKWBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO3/c1-4-19-14-7-5-13(6-8-14)11-17(3)16(18)15-12(2)9-10-20-15/h5-10H,4,11H2,1-3H3.
What are the key properties of N-[(4-ethoxyphenyl)methyl]-N,3-dimethylfuran-2-carboxamide?
N-[(4-ethoxyphenyl)methyl]-N,3-dimethylfuran-2-carboxamide has a molecular weight of 273.33 g/mol, XLogP of 3.26, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-ethoxyphenyl)methyl]-N,3-dimethylfuran-2-carboxamide is sourced from PubChem (CID 134044703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).