N-(oxolan-2-ylmethyl)thiophene-2-carboxamide

C10H13NO2S — CID 531922

IUPACN-(oxolan-2-ylmethyl)thiophene-2-carboxamide
SMILESO=C(NCC1CCCO1)c1cccs1
InChIInChI=1S/C10H13NO2S/c12-10(9-4-2-6-14-9)11-7-8-3-1-5-13-8/h2,4,6,8H,1,3,5,7H2,(H,11,12)
InChIKeyZVEOKBMFOXDDJU-UHFFFAOYSA-N
MW211.29 g/mol
LogP1.66
Rot. Bonds3

About N-(oxolan-2-ylmethyl)thiophene-2-carboxamide

N-(oxolan-2-ylmethyl)thiophene-2-carboxamide (PubChem CID 531922) has the molecular formula C10H13NO2S and a molecular weight of 211.29 g/mol. Its IUPAC name is N-(oxolan-2-ylmethyl)thiophene-2-carboxamide.

Molecular Properties

Compound NameN-(oxolan-2-ylmethyl)thiophene-2-carboxamide
PubChem CID531922
Molecular FormulaC10H13NO2S
Molecular Weight211.29 g/mol
Exact Mass211.07
IUPAC NameN-(oxolan-2-ylmethyl)thiophene-2-carboxamide
SMILESO=C(NCC1CCCO1)c1cccs1
InChIInChI=1S/C10H13NO2S/c12-10(9-4-2-6-14-9)11-7-8-3-1-5-13-8/h2,4,6,8H,1,3,5,7H2,(H,11,12)
InChIKeyZVEOKBMFOXDDJU-UHFFFAOYSA-N
XLogP1.66
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.29
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(oxolan-2-ylmethyl)thiophene-2-carboxamide?
The IUPAC name of N-(oxolan-2-ylmethyl)thiophene-2-carboxamide (CID 531922) is N-(oxolan-2-ylmethyl)thiophene-2-carboxamide.
What is the SMILES notation for N-(oxolan-2-ylmethyl)thiophene-2-carboxamide?
The canonical SMILES for N-(oxolan-2-ylmethyl)thiophene-2-carboxamide is O=C(NCC1CCCO1)c1cccs1.
What is the InChIKey of N-(oxolan-2-ylmethyl)thiophene-2-carboxamide?
The InChIKey is ZVEOKBMFOXDDJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13NO2S/c12-10(9-4-2-6-14-9)11-7-8-3-1-5-13-8/h2,4,6,8H,1,3,5,7H2,(H,11,12).
What are the key properties of N-(oxolan-2-ylmethyl)thiophene-2-carboxamide?
N-(oxolan-2-ylmethyl)thiophene-2-carboxamide has a molecular weight of 211.29 g/mol, XLogP of 1.66, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(oxolan-2-ylmethyl)thiophene-2-carboxamide is sourced from PubChem (CID 531922), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).