N-morpholin-4-ylthiophene-2-carboxamide

C9H12N2O2S — CID 819242

IUPACN-morpholin-4-ylthiophene-2-carboxamide
SMILESO=C(NN1CCOCC1)c1cccs1
InChIInChI=1S/C9H12N2O2S/c12-9(8-2-1-7-14-8)10-11-3-5-13-6-4-11/h1-2,7H,3-6H2,(H,10,12)
InChIKeyGZFIKWZCBKYKPZ-UHFFFAOYSA-N
MW212.27 g/mol
LogP0.73
Rot. Bonds2

About N-morpholin-4-ylthiophene-2-carboxamide

N-morpholin-4-ylthiophene-2-carboxamide (PubChem CID 819242) has the molecular formula C9H12N2O2S and a molecular weight of 212.27 g/mol. Its IUPAC name is N-morpholin-4-ylthiophene-2-carboxamide.

Molecular Properties

Compound NameN-morpholin-4-ylthiophene-2-carboxamide
PubChem CID819242
Molecular FormulaC9H12N2O2S
Molecular Weight212.27 g/mol
Exact Mass212.06
IUPAC NameN-morpholin-4-ylthiophene-2-carboxamide
SMILESO=C(NN1CCOCC1)c1cccs1
InChIInChI=1S/C9H12N2O2S/c12-9(8-2-1-7-14-8)10-11-3-5-13-6-4-11/h1-2,7H,3-6H2,(H,10,12)
InChIKeyGZFIKWZCBKYKPZ-UHFFFAOYSA-N
XLogP0.73
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.27
LogP ≤ 50.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-morpholin-4-ylthiophene-2-carboxamide?
The IUPAC name of N-morpholin-4-ylthiophene-2-carboxamide (CID 819242) is N-morpholin-4-ylthiophene-2-carboxamide.
What is the SMILES notation for N-morpholin-4-ylthiophene-2-carboxamide?
The canonical SMILES for N-morpholin-4-ylthiophene-2-carboxamide is O=C(NN1CCOCC1)c1cccs1.
What is the InChIKey of N-morpholin-4-ylthiophene-2-carboxamide?
The InChIKey is GZFIKWZCBKYKPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N2O2S/c12-9(8-2-1-7-14-8)10-11-3-5-13-6-4-11/h1-2,7H,3-6H2,(H,10,12).
What are the key properties of N-morpholin-4-ylthiophene-2-carboxamide?
N-morpholin-4-ylthiophene-2-carboxamide has a molecular weight of 212.27 g/mol, XLogP of 0.73, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-morpholin-4-ylthiophene-2-carboxamide is sourced from PubChem (CID 819242), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).