N-(2-methyl-2-morpholin-4-ylpropyl)thiophene-2-carboxamide

C13H20N2O2S — CID 25162372

IUPACN-(2-methyl-2-morpholin-4-ylpropyl)thiophene-2-carboxamide
SMILESCC(C)(CNC(=O)c1cccs1)N1CCOCC1
InChIInChI=1S/C13H20N2O2S/c1-13(2,15-5-7-17-8-6-15)10-14-12(16)11-4-3-9-18-11/h3-4,9H,5-8,10H2,1-2H3,(H,14,16)
InChIKeyOCEJHSWPHJCEHB-UHFFFAOYSA-N
MW268.38 g/mol
LogP1.59
Rot. Bonds4

About N-(2-methyl-2-morpholin-4-ylpropyl)thiophene-2-carboxamide

N-(2-methyl-2-morpholin-4-ylpropyl)thiophene-2-carboxamide (PubChem CID 25162372) has the molecular formula C13H20N2O2S and a molecular weight of 268.38 g/mol. Its IUPAC name is N-(2-methyl-2-morpholin-4-ylpropyl)thiophene-2-carboxamide.

Molecular Properties

Compound NameN-(2-methyl-2-morpholin-4-ylpropyl)thiophene-2-carboxamide
PubChem CID25162372
Molecular FormulaC13H20N2O2S
Molecular Weight268.38 g/mol
Exact Mass268.12
IUPAC NameN-(2-methyl-2-morpholin-4-ylpropyl)thiophene-2-carboxamide
SMILESCC(C)(CNC(=O)c1cccs1)N1CCOCC1
InChIInChI=1S/C13H20N2O2S/c1-13(2,15-5-7-17-8-6-15)10-14-12(16)11-4-3-9-18-11/h3-4,9H,5-8,10H2,1-2H3,(H,14,16)
InChIKeyOCEJHSWPHJCEHB-UHFFFAOYSA-N
XLogP1.59
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.38
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2-methyl-2-morpholin-4-ylpropyl)thiophene-2-carboxamide?
The IUPAC name of N-(2-methyl-2-morpholin-4-ylpropyl)thiophene-2-carboxamide (CID 25162372) is N-(2-methyl-2-morpholin-4-ylpropyl)thiophene-2-carboxamide.
What is the SMILES notation for N-(2-methyl-2-morpholin-4-ylpropyl)thiophene-2-carboxamide?
The canonical SMILES for N-(2-methyl-2-morpholin-4-ylpropyl)thiophene-2-carboxamide is CC(C)(CNC(=O)c1cccs1)N1CCOCC1.
What is the InChIKey of N-(2-methyl-2-morpholin-4-ylpropyl)thiophene-2-carboxamide?
The InChIKey is OCEJHSWPHJCEHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O2S/c1-13(2,15-5-7-17-8-6-15)10-14-12(16)11-4-3-9-18-11/h3-4,9H,5-8,10H2,1-2H3,(H,14,16).
What are the key properties of N-(2-methyl-2-morpholin-4-ylpropyl)thiophene-2-carboxamide?
N-(2-methyl-2-morpholin-4-ylpropyl)thiophene-2-carboxamide has a molecular weight of 268.38 g/mol, XLogP of 1.59, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methyl-2-morpholin-4-ylpropyl)thiophene-2-carboxamide is sourced from PubChem (CID 25162372), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).