4-ethyl-5-methyl-N-(2-phenoxyethyl)thiophene-2-carboxamide

C16H19NO2S — CID 32933112

IUPAC4-ethyl-5-methyl-N-(2-phenoxyethyl)thiophene-2-carboxamide
SMILESCCc1cc(C(=O)NCCOc2ccccc2)sc1C
InChIInChI=1S/C16H19NO2S/c1-3-13-11-15(20-12(13)2)16(18)17-9-10-19-14-7-5-4-6-8-14/h4-8,11H,3,9-10H2,1-2H3,(H,17,18)
InChIKeyMQBYFSBNADOSCL-UHFFFAOYSA-N
MW289.40 g/mol
LogP3.43
Rot. Bonds6

About 4-ethyl-5-methyl-N-(2-phenoxyethyl)thiophene-2-carboxamide

4-ethyl-5-methyl-N-(2-phenoxyethyl)thiophene-2-carboxamide (PubChem CID 32933112) has the molecular formula C16H19NO2S and a molecular weight of 289.40 g/mol. Its IUPAC name is 4-ethyl-5-methyl-N-(2-phenoxyethyl)thiophene-2-carboxamide.

Molecular Properties

Compound Name4-ethyl-5-methyl-N-(2-phenoxyethyl)thiophene-2-carboxamide
PubChem CID32933112
Molecular FormulaC16H19NO2S
Molecular Weight289.40 g/mol
Exact Mass289.11
IUPAC Name4-ethyl-5-methyl-N-(2-phenoxyethyl)thiophene-2-carboxamide
SMILESCCc1cc(C(=O)NCCOc2ccccc2)sc1C
InChIInChI=1S/C16H19NO2S/c1-3-13-11-15(20-12(13)2)16(18)17-9-10-19-14-7-5-4-6-8-14/h4-8,11H,3,9-10H2,1-2H3,(H,17,18)
InChIKeyMQBYFSBNADOSCL-UHFFFAOYSA-N
XLogP3.43
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.40
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

4-ethyl-N-[2-(4-methoxyphenoxy)ethyl]-5-methylthiophene-2-carboxamide
CID 24551130
4-ethyl-N-[2-(4-fluorophenoxy)ethyl]-5-methylthiophene-2-carboxamide
CID 37363004
4-ethyl-5-methyl-N-propylthiophene-2-carboxamide
CID 60637688
4-ethyl-5-methyl-N-[3-(N-methylanilino)propyl]thiophene-2-carboxamide
CID 37315774
1,3-dimethyl-N-(2-phenoxyethyl)thieno[3,2-d]pyrazole-5-carboxamide
CID 51304942
4-ethyl-5-methyl-N-(2-propoxyphenyl)thiophene-2-carboxamide
CID 30235573
4-ethyl-5-methyl-N-[2-(2-nitroanilino)ethyl]thiophene-2-carboxamide
CID 9278788
3-[(4-ethyl-5-methylthiophene-2-carbonyl)amino]-2,2-dimethylpropanoic acid
CID 81367795
N-(2-phenoxyethyl)-5-(phenylcarbamoylamino)thiophene-2-carboxamide
CID 78846484
2-bromo-N-(2-phenoxyethyl)propanamide
CID 82108617
4-methoxy-3-methyl-N-(2-phenoxyethyl)benzamide
CID 100543454
2-N,5-N-bis[2-(2-methylphenoxy)ethyl]thiophene-2,5-dicarboxamide
CID 2227968

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-5-methyl-N-(2-phenoxyethyl)thiophene-2-carboxamide?
The IUPAC name of 4-ethyl-5-methyl-N-(2-phenoxyethyl)thiophene-2-carboxamide (CID 32933112) is 4-ethyl-5-methyl-N-(2-phenoxyethyl)thiophene-2-carboxamide.
What is the SMILES notation for 4-ethyl-5-methyl-N-(2-phenoxyethyl)thiophene-2-carboxamide?
The canonical SMILES for 4-ethyl-5-methyl-N-(2-phenoxyethyl)thiophene-2-carboxamide is CCc1cc(C(=O)NCCOc2ccccc2)sc1C.
What is the InChIKey of 4-ethyl-5-methyl-N-(2-phenoxyethyl)thiophene-2-carboxamide?
The InChIKey is MQBYFSBNADOSCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO2S/c1-3-13-11-15(20-12(13)2)16(18)17-9-10-19-14-7-5-4-6-8-14/h4-8,11H,3,9-10H2,1-2H3,(H,17,18).
What are the key properties of 4-ethyl-5-methyl-N-(2-phenoxyethyl)thiophene-2-carboxamide?
4-ethyl-5-methyl-N-(2-phenoxyethyl)thiophene-2-carboxamide has a molecular weight of 289.40 g/mol, XLogP of 3.43, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-5-methyl-N-(2-phenoxyethyl)thiophene-2-carboxamide is sourced from PubChem (CID 32933112), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).