N-(2-methyl-2-morpholin-4-ylpropyl)-3-thiophen-3-ylpropanamide

C15H24N2O2S — CID 39958789

IUPACN-(2-methyl-2-morpholin-4-ylpropyl)-3-thiophen-3-ylpropanamide
SMILESCC(C)(CNC(=O)CCc1ccsc1)N1CCOCC1
InChIInChI=1S/C15H24N2O2S/c1-15(2,17-6-8-19-9-7-17)12-16-14(18)4-3-13-5-10-20-11-13/h5,10-11H,3-4,6-9,12H2,1-2H3,(H,16,18)
InChIKeyCIRJVRXREOCAGY-UHFFFAOYSA-N
MW296.44 g/mol
LogP1.91
Rot. Bonds6

About N-(2-methyl-2-morpholin-4-ylpropyl)-3-thiophen-3-ylpropanamide

N-(2-methyl-2-morpholin-4-ylpropyl)-3-thiophen-3-ylpropanamide (PubChem CID 39958789) has the molecular formula C15H24N2O2S and a molecular weight of 296.44 g/mol. Its IUPAC name is N-(2-methyl-2-morpholin-4-ylpropyl)-3-thiophen-3-ylpropanamide.

Molecular Properties

Compound NameN-(2-methyl-2-morpholin-4-ylpropyl)-3-thiophen-3-ylpropanamide
PubChem CID39958789
Molecular FormulaC15H24N2O2S
Molecular Weight296.44 g/mol
Exact Mass296.16
IUPAC NameN-(2-methyl-2-morpholin-4-ylpropyl)-3-thiophen-3-ylpropanamide
SMILESCC(C)(CNC(=O)CCc1ccsc1)N1CCOCC1
InChIInChI=1S/C15H24N2O2S/c1-15(2,17-6-8-19-9-7-17)12-16-14(18)4-3-13-5-10-20-11-13/h5,10-11H,3-4,6-9,12H2,1-2H3,(H,16,18)
InChIKeyCIRJVRXREOCAGY-UHFFFAOYSA-N
XLogP1.91
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.44
LogP ≤ 51.91
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)-3-thiophen-3-ylpropanamide?
The IUPAC name of N-(2-methyl-2-morpholin-4-ylpropyl)-3-thiophen-3-ylpropanamide (CID 39958789) is N-(2-methyl-2-morpholin-4-ylpropyl)-3-thiophen-3-ylpropanamide.
What is the SMILES notation for N-(2-methyl-2-morpholin-4-ylpropyl)-3-thiophen-3-ylpropanamide?
The canonical SMILES for N-(2-methyl-2-morpholin-4-ylpropyl)-3-thiophen-3-ylpropanamide is CC(C)(CNC(=O)CCc1ccsc1)N1CCOCC1.
What is the InChIKey of N-(2-methyl-2-morpholin-4-ylpropyl)-3-thiophen-3-ylpropanamide?
The InChIKey is CIRJVRXREOCAGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2S/c1-15(2,17-6-8-19-9-7-17)12-16-14(18)4-3-13-5-10-20-11-13/h5,10-11H,3-4,6-9,12H2,1-2H3,(H,16,18).
What are the key properties of N-(2-methyl-2-morpholin-4-ylpropyl)-3-thiophen-3-ylpropanamide?
N-(2-methyl-2-morpholin-4-ylpropyl)-3-thiophen-3-ylpropanamide has a molecular weight of 296.44 g/mol, XLogP of 1.91, 6 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)-3-thiophen-3-ylpropanamide is sourced from PubChem (CID 39958789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).