5-ethyl-N-methyl-N-(4-methylphenyl)furan-2-carboxamide

C15H17NO2 — CID 52850973

IUPAC5-ethyl-N-methyl-N-(4-methylphenyl)furan-2-carboxamide
SMILESCCc1ccc(C(=O)N(C)c2ccc(C)cc2)o1
InChIInChI=1S/C15H17NO2/c1-4-13-9-10-14(18-13)15(17)16(3)12-7-5-11(2)6-8-12/h5-10H,4H2,1-3H3
InChIKeyUDTJSBKCRYHAIG-UHFFFAOYSA-N
MW243.31 g/mol
LogP3.43
Rot. Bonds3

About 5-ethyl-N-methyl-N-(4-methylphenyl)furan-2-carboxamide

5-ethyl-N-methyl-N-(4-methylphenyl)furan-2-carboxamide (PubChem CID 52850973) has the molecular formula C15H17NO2 and a molecular weight of 243.31 g/mol. Its IUPAC name is 5-ethyl-N-methyl-N-(4-methylphenyl)furan-2-carboxamide.

Molecular Properties

Compound Name5-ethyl-N-methyl-N-(4-methylphenyl)furan-2-carboxamide
PubChem CID52850973
Molecular FormulaC15H17NO2
Molecular Weight243.31 g/mol
Exact Mass243.13
IUPAC Name5-ethyl-N-methyl-N-(4-methylphenyl)furan-2-carboxamide
SMILESCCc1ccc(C(=O)N(C)c2ccc(C)cc2)o1
InChIInChI=1S/C15H17NO2/c1-4-13-9-10-14(18-13)15(17)16(3)12-7-5-11(2)6-8-12/h5-10H,4H2,1-3H3
InChIKeyUDTJSBKCRYHAIG-UHFFFAOYSA-N
XLogP3.43
TPSA33.45 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.31
LogP ≤ 53.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-ethyl-N-methyl-N-(4-methylphenyl)furan-2-carboxamide?
The IUPAC name of 5-ethyl-N-methyl-N-(4-methylphenyl)furan-2-carboxamide (CID 52850973) is 5-ethyl-N-methyl-N-(4-methylphenyl)furan-2-carboxamide.
What is the SMILES notation for 5-ethyl-N-methyl-N-(4-methylphenyl)furan-2-carboxamide?
The canonical SMILES for 5-ethyl-N-methyl-N-(4-methylphenyl)furan-2-carboxamide is CCc1ccc(C(=O)N(C)c2ccc(C)cc2)o1.
What is the InChIKey of 5-ethyl-N-methyl-N-(4-methylphenyl)furan-2-carboxamide?
The InChIKey is UDTJSBKCRYHAIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO2/c1-4-13-9-10-14(18-13)15(17)16(3)12-7-5-11(2)6-8-12/h5-10H,4H2,1-3H3.
What are the key properties of 5-ethyl-N-methyl-N-(4-methylphenyl)furan-2-carboxamide?
5-ethyl-N-methyl-N-(4-methylphenyl)furan-2-carboxamide has a molecular weight of 243.31 g/mol, XLogP of 3.43, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-N-methyl-N-(4-methylphenyl)furan-2-carboxamide is sourced from PubChem (CID 52850973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).