N-methyl-N-(2-phenoxyethyl)thiophene-2-carboxamide

C14H15NO2S — CID 60630814

IUPACN-methyl-N-(2-phenoxyethyl)thiophene-2-carboxamide
SMILESCN(CCOc1ccccc1)C(=O)c1cccs1
InChIInChI=1S/C14H15NO2S/c1-15(14(16)13-8-5-11-18-13)9-10-17-12-6-3-2-4-7-12/h2-8,11H,9-10H2,1H3
InChIKeyNMMWASRSHYYVLU-UHFFFAOYSA-N
MW261.35 g/mol
LogP2.90
Rot. Bonds5

About N-methyl-N-(2-phenoxyethyl)thiophene-2-carboxamide

N-methyl-N-(2-phenoxyethyl)thiophene-2-carboxamide (PubChem CID 60630814) has the molecular formula C14H15NO2S and a molecular weight of 261.35 g/mol. Its IUPAC name is N-methyl-N-(2-phenoxyethyl)thiophene-2-carboxamide.

Molecular Properties

Compound NameN-methyl-N-(2-phenoxyethyl)thiophene-2-carboxamide
PubChem CID60630814
Molecular FormulaC14H15NO2S
Molecular Weight261.35 g/mol
Exact Mass261.08
IUPAC NameN-methyl-N-(2-phenoxyethyl)thiophene-2-carboxamide
SMILESCN(CCOc1ccccc1)C(=O)c1cccs1
InChIInChI=1S/C14H15NO2S/c1-15(14(16)13-8-5-11-18-13)9-10-17-12-6-3-2-4-7-12/h2-8,11H,9-10H2,1H3
InChIKeyNMMWASRSHYYVLU-UHFFFAOYSA-N
XLogP2.90
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.35
LogP ≤ 52.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(2-phenoxyethyl)thiophene-2-carboxamide?
The IUPAC name of N-methyl-N-(2-phenoxyethyl)thiophene-2-carboxamide (CID 60630814) is N-methyl-N-(2-phenoxyethyl)thiophene-2-carboxamide.
What is the SMILES notation for N-methyl-N-(2-phenoxyethyl)thiophene-2-carboxamide?
The canonical SMILES for N-methyl-N-(2-phenoxyethyl)thiophene-2-carboxamide is CN(CCOc1ccccc1)C(=O)c1cccs1.
What is the InChIKey of N-methyl-N-(2-phenoxyethyl)thiophene-2-carboxamide?
The InChIKey is NMMWASRSHYYVLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15NO2S/c1-15(14(16)13-8-5-11-18-13)9-10-17-12-6-3-2-4-7-12/h2-8,11H,9-10H2,1H3.
What are the key properties of N-methyl-N-(2-phenoxyethyl)thiophene-2-carboxamide?
N-methyl-N-(2-phenoxyethyl)thiophene-2-carboxamide has a molecular weight of 261.35 g/mol, XLogP of 2.90, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(2-phenoxyethyl)thiophene-2-carboxamide is sourced from PubChem (CID 60630814), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).