N-(4-hydroxyphenyl)-N-methylthiophene-2-carboxamide

C12H11NO2S — CID 3713660

IUPACN-(4-hydroxyphenyl)-N-methylthiophene-2-carboxamide
SMILESCN(C(=O)c1cccs1)c1ccc(O)cc1
InChIInChI=1S/C12H11NO2S/c1-13(9-4-6-10(14)7-5-9)12(15)11-3-2-8-16-11/h2-8,14H,1H3
InChIKeyLTCVSWVAJHCFCB-UHFFFAOYSA-N
MW233.29 g/mol
LogP2.73
Rot. Bonds2

About N-(4-hydroxyphenyl)-N-methylthiophene-2-carboxamide

N-(4-hydroxyphenyl)-N-methylthiophene-2-carboxamide (PubChem CID 3713660) has the molecular formula C12H11NO2S and a molecular weight of 233.29 g/mol. Its IUPAC name is N-(4-hydroxyphenyl)-N-methylthiophene-2-carboxamide.

Molecular Properties

Compound NameN-(4-hydroxyphenyl)-N-methylthiophene-2-carboxamide
PubChem CID3713660
Molecular FormulaC12H11NO2S
Molecular Weight233.29 g/mol
Exact Mass233.05
IUPAC NameN-(4-hydroxyphenyl)-N-methylthiophene-2-carboxamide
SMILESCN(C(=O)c1cccs1)c1ccc(O)cc1
InChIInChI=1S/C12H11NO2S/c1-13(9-4-6-10(14)7-5-9)12(15)11-3-2-8-16-11/h2-8,14H,1H3
InChIKeyLTCVSWVAJHCFCB-UHFFFAOYSA-N
XLogP2.73
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.29
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(4-hydroxyphenyl)-N-methylthiophene-2-carboxamide?
The IUPAC name of N-(4-hydroxyphenyl)-N-methylthiophene-2-carboxamide (CID 3713660) is N-(4-hydroxyphenyl)-N-methylthiophene-2-carboxamide.
What is the SMILES notation for N-(4-hydroxyphenyl)-N-methylthiophene-2-carboxamide?
The canonical SMILES for N-(4-hydroxyphenyl)-N-methylthiophene-2-carboxamide is CN(C(=O)c1cccs1)c1ccc(O)cc1.
What is the InChIKey of N-(4-hydroxyphenyl)-N-methylthiophene-2-carboxamide?
The InChIKey is LTCVSWVAJHCFCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11NO2S/c1-13(9-4-6-10(14)7-5-9)12(15)11-3-2-8-16-11/h2-8,14H,1H3.
What are the key properties of N-(4-hydroxyphenyl)-N-methylthiophene-2-carboxamide?
N-(4-hydroxyphenyl)-N-methylthiophene-2-carboxamide has a molecular weight of 233.29 g/mol, XLogP of 2.73, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-hydroxyphenyl)-N-methylthiophene-2-carboxamide is sourced from PubChem (CID 3713660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).