N,4-diethyl-N-[2-(4-methoxyanilino)-2-oxoethyl]-5-methylthiophene-2-carboxamide

C19H24N2O3S — CID 25163792

IUPACN,4-diethyl-N-[2-(4-methoxyanilino)-2-oxoethyl]-5-methylthiophene-2-carboxamide
SMILESCCc1cc(C(=O)N(CC)CC(=O)Nc2ccc(OC)cc2)sc1C
InChIInChI=1S/C19H24N2O3S/c1-5-14-11-17(25-13(14)3)19(23)21(6-2)12-18(22)20-15-7-9-16(24-4)10-8-15/h7-11H,5-6,12H2,1-4H3,(H,20,22)
InChIKeyVPGOPISCTDZRMI-UHFFFAOYSA-N
MW360.48 g/mol
LogP3.73
Rot. Bonds7

About N,4-diethyl-N-[2-(4-methoxyanilino)-2-oxoethyl]-5-methylthiophene-2-carboxamide

N,4-diethyl-N-[2-(4-methoxyanilino)-2-oxoethyl]-5-methylthiophene-2-carboxamide (PubChem CID 25163792) has the molecular formula C19H24N2O3S and a molecular weight of 360.48 g/mol. Its IUPAC name is N,4-diethyl-N-[2-(4-methoxyanilino)-2-oxoethyl]-5-methylthiophene-2-carboxamide.

Molecular Properties

Compound NameN,4-diethyl-N-[2-(4-methoxyanilino)-2-oxoethyl]-5-methylthiophene-2-carboxamide
PubChem CID25163792
Molecular FormulaC19H24N2O3S
Molecular Weight360.48 g/mol
Exact Mass360.15
IUPAC NameN,4-diethyl-N-[2-(4-methoxyanilino)-2-oxoethyl]-5-methylthiophene-2-carboxamide
SMILESCCc1cc(C(=O)N(CC)CC(=O)Nc2ccc(OC)cc2)sc1C
InChIInChI=1S/C19H24N2O3S/c1-5-14-11-17(25-13(14)3)19(23)21(6-2)12-18(22)20-15-7-9-16(24-4)10-8-15/h7-11H,5-6,12H2,1-4H3,(H,20,22)
InChIKeyVPGOPISCTDZRMI-UHFFFAOYSA-N
XLogP3.73
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.48
LogP ≤ 53.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N,4-diethyl-N-[2-(4-methoxyanilino)-2-oxoethyl]-5-methylthiophene-2-carboxamide?
The IUPAC name of N,4-diethyl-N-[2-(4-methoxyanilino)-2-oxoethyl]-5-methylthiophene-2-carboxamide (CID 25163792) is N,4-diethyl-N-[2-(4-methoxyanilino)-2-oxoethyl]-5-methylthiophene-2-carboxamide.
What is the SMILES notation for N,4-diethyl-N-[2-(4-methoxyanilino)-2-oxoethyl]-5-methylthiophene-2-carboxamide?
The canonical SMILES for N,4-diethyl-N-[2-(4-methoxyanilino)-2-oxoethyl]-5-methylthiophene-2-carboxamide is CCc1cc(C(=O)N(CC)CC(=O)Nc2ccc(OC)cc2)sc1C.
What is the InChIKey of N,4-diethyl-N-[2-(4-methoxyanilino)-2-oxoethyl]-5-methylthiophene-2-carboxamide?
The InChIKey is VPGOPISCTDZRMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O3S/c1-5-14-11-17(25-13(14)3)19(23)21(6-2)12-18(22)20-15-7-9-16(24-4)10-8-15/h7-11H,5-6,12H2,1-4H3,(H,20,22).
What are the key properties of N,4-diethyl-N-[2-(4-methoxyanilino)-2-oxoethyl]-5-methylthiophene-2-carboxamide?
N,4-diethyl-N-[2-(4-methoxyanilino)-2-oxoethyl]-5-methylthiophene-2-carboxamide has a molecular weight of 360.48 g/mol, XLogP of 3.73, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,4-diethyl-N-[2-(4-methoxyanilino)-2-oxoethyl]-5-methylthiophene-2-carboxamide is sourced from PubChem (CID 25163792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).