N,5-dimethyl-N-[2-(4-methylanilino)-2-oxoethyl]-4-propylthiophene-2-carboxamide

C19H24N2O2S — CID 9374479

IUPACN,5-dimethyl-N-[2-(4-methylanilino)-2-oxoethyl]-4-propylthiophene-2-carboxamide
SMILESCCCc1cc(C(=O)N(C)CC(=O)Nc2ccc(C)cc2)sc1C
InChIInChI=1S/C19H24N2O2S/c1-5-6-15-11-17(24-14(15)3)19(23)21(4)12-18(22)20-16-9-7-13(2)8-10-16/h7-11H,5-6,12H2,1-4H3,(H,20,22)
InChIKeyPSSQZJWJEBDSBQ-UHFFFAOYSA-N
MW344.48 g/mol
LogP4.03
Rot. Bonds6

About N,5-dimethyl-N-[2-(4-methylanilino)-2-oxoethyl]-4-propylthiophene-2-carboxamide

N,5-dimethyl-N-[2-(4-methylanilino)-2-oxoethyl]-4-propylthiophene-2-carboxamide (PubChem CID 9374479) has the molecular formula C19H24N2O2S and a molecular weight of 344.48 g/mol. Its IUPAC name is N,5-dimethyl-N-[2-(4-methylanilino)-2-oxoethyl]-4-propylthiophene-2-carboxamide.

Molecular Properties

Compound NameN,5-dimethyl-N-[2-(4-methylanilino)-2-oxoethyl]-4-propylthiophene-2-carboxamide
PubChem CID9374479
Molecular FormulaC19H24N2O2S
Molecular Weight344.48 g/mol
Exact Mass344.16
IUPAC NameN,5-dimethyl-N-[2-(4-methylanilino)-2-oxoethyl]-4-propylthiophene-2-carboxamide
SMILESCCCc1cc(C(=O)N(C)CC(=O)Nc2ccc(C)cc2)sc1C
InChIInChI=1S/C19H24N2O2S/c1-5-6-15-11-17(24-14(15)3)19(23)21(4)12-18(22)20-16-9-7-13(2)8-10-16/h7-11H,5-6,12H2,1-4H3,(H,20,22)
InChIKeyPSSQZJWJEBDSBQ-UHFFFAOYSA-N
XLogP4.03
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.48
LogP ≤ 54.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-ethyl-N-methyl-N-[2-(4-methylanilino)-2-oxoethyl]-5-propylthiophene-2-carboxamide
CID 9374448
5-methyl-N-(4-methylphenyl)-4-propylthiophene-2-carboxamide
CID 7899856
[2-(4-methylanilino)-2-oxoethyl] 5-methyl-4-propylthiophene-2-carboxylate
CID 7683646
N-methyl-N-[2-(4-methylanilino)-2-oxoethyl]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carboxamide
CID 18104437
4-ethyl-N-methyl-N-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]-5-propylthiophene-2-carboxamide
CID 9186331
5-(2-fluorophenyl)-N-methyl-N-[2-(4-methylanilino)-2-oxoethyl]thiophene-2-carboxamide
CID 55605253
N,4,5-trimethyl-N-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]thiophene-2-carboxamide
CID 31523361
5-methyl-4-propyl-N-pyridin-4-ylthiophene-2-carboxamide
CID 27699944
N',N',5-trimethyl-4-propylthiophene-2-carbohydrazide
CID 9179994
N,3-dimethyl-N-[2-(4-methylanilino)-2-oxoethyl]furan-2-carboxamide
CID 38005582
N-methyl-N-[2-(4-methylanilino)-2-oxoethyl]-4-phenylbenzamide
CID 9494059
4-tert-butyl-N-methyl-N-[2-(4-methylanilino)-2-oxoethyl]benzamide
CID 40728961

Frequently Asked Questions

What is the IUPAC name of N,5-dimethyl-N-[2-(4-methylanilino)-2-oxoethyl]-4-propylthiophene-2-carboxamide?
The IUPAC name of N,5-dimethyl-N-[2-(4-methylanilino)-2-oxoethyl]-4-propylthiophene-2-carboxamide (CID 9374479) is N,5-dimethyl-N-[2-(4-methylanilino)-2-oxoethyl]-4-propylthiophene-2-carboxamide.
What is the SMILES notation for N,5-dimethyl-N-[2-(4-methylanilino)-2-oxoethyl]-4-propylthiophene-2-carboxamide?
The canonical SMILES for N,5-dimethyl-N-[2-(4-methylanilino)-2-oxoethyl]-4-propylthiophene-2-carboxamide is CCCc1cc(C(=O)N(C)CC(=O)Nc2ccc(C)cc2)sc1C.
What is the InChIKey of N,5-dimethyl-N-[2-(4-methylanilino)-2-oxoethyl]-4-propylthiophene-2-carboxamide?
The InChIKey is PSSQZJWJEBDSBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O2S/c1-5-6-15-11-17(24-14(15)3)19(23)21(4)12-18(22)20-16-9-7-13(2)8-10-16/h7-11H,5-6,12H2,1-4H3,(H,20,22).
What are the key properties of N,5-dimethyl-N-[2-(4-methylanilino)-2-oxoethyl]-4-propylthiophene-2-carboxamide?
N,5-dimethyl-N-[2-(4-methylanilino)-2-oxoethyl]-4-propylthiophene-2-carboxamide has a molecular weight of 344.48 g/mol, XLogP of 4.03, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,5-dimethyl-N-[2-(4-methylanilino)-2-oxoethyl]-4-propylthiophene-2-carboxamide is sourced from PubChem (CID 9374479), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).