N-(2-hydroxyethyl)thiophene-3-carboxamide

C7H9NO2S — CID 43391583

IUPACN-(2-hydroxyethyl)thiophene-3-carboxamide
SMILESO=C(NCCO)c1ccsc1
InChIInChI=1S/C7H9NO2S/c9-3-2-8-7(10)6-1-4-11-5-6/h1,4-5,9H,2-3H2,(H,8,10)
InChIKeyDSVDSQDXIQOJBK-UHFFFAOYSA-N
MW171.22 g/mol
LogP0.47
Rot. Bonds3

About N-(2-hydroxyethyl)thiophene-3-carboxamide

N-(2-hydroxyethyl)thiophene-3-carboxamide (PubChem CID 43391583) has the molecular formula C7H9NO2S and a molecular weight of 171.22 g/mol. Its IUPAC name is N-(2-hydroxyethyl)thiophene-3-carboxamide.

Molecular Properties

Compound NameN-(2-hydroxyethyl)thiophene-3-carboxamide
PubChem CID43391583
Molecular FormulaC7H9NO2S
Molecular Weight171.22 g/mol
Exact Mass171.04
IUPAC NameN-(2-hydroxyethyl)thiophene-3-carboxamide
SMILESO=C(NCCO)c1ccsc1
InChIInChI=1S/C7H9NO2S/c9-3-2-8-7(10)6-1-4-11-5-6/h1,4-5,9H,2-3H2,(H,8,10)
InChIKeyDSVDSQDXIQOJBK-UHFFFAOYSA-N
XLogP0.47
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.22
LogP ≤ 50.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-methylthiophene-3-carboxamide
CID 819553
N-(2-hydroxy-2-methyl-4-(methylthio)butyl)thiophene-3-carboxamide
CID 71787267
N-((3-methoxytetrahydrothiophen-3-yl)methyl)thiophene-3-carboxamide
CID 71804815
2-(Thiophen-3-ylformamido)acetic acid
CID 3055286
N-[(Oxan-4-YL)methyl]thiophene-3-carboxamide
CID 110875679
N-Ethylthiophene-3-carboxamide
CID 15452328
N-Propylthiophene-3-carboxamide
CID 23273494
N-(2-hydroxy-3-methoxy-2-methylpropyl)thiophene-3-carboxamide
CID 56724179
N-(4-morpholinobut-2-yn-1-yl)thiophene-3-carboxamide
CID 71792704
N-(2-hydroxy-3-(2-oxopyridin-1(2H)-yl)propyl)thiophene-3-carboxamide
CID 76150344
N-(2-((tetrahydro-2H-pyran-4-yl)thio)ethyl)thiophene-3-carboxamide
CID 86265175
N-[(S)-2-hydroxy-2-methyl-4-(methylthio)butyl]-3-thenamide
CID 95984273

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxyethyl)thiophene-3-carboxamide?
The IUPAC name of N-(2-hydroxyethyl)thiophene-3-carboxamide (CID 43391583) is N-(2-hydroxyethyl)thiophene-3-carboxamide.
What is the SMILES notation for N-(2-hydroxyethyl)thiophene-3-carboxamide?
The canonical SMILES for N-(2-hydroxyethyl)thiophene-3-carboxamide is O=C(NCCO)c1ccsc1.
What is the InChIKey of N-(2-hydroxyethyl)thiophene-3-carboxamide?
The InChIKey is DSVDSQDXIQOJBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9NO2S/c9-3-2-8-7(10)6-1-4-11-5-6/h1,4-5,9H,2-3H2,(H,8,10).
What are the key properties of N-(2-hydroxyethyl)thiophene-3-carboxamide?
N-(2-hydroxyethyl)thiophene-3-carboxamide has a molecular weight of 171.22 g/mol, XLogP of 0.47, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxyethyl)thiophene-3-carboxamide is sourced from PubChem (CID 43391583), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).