N-(1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl)propanamide

C14H22N2O2S — CID 3245518

IUPACN-(1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl)propanamide
SMILESCCC(=O)NC(C)C(c1cccs1)N1CCOCC1
InChIInChI=1S/C14H22N2O2S/c1-3-13(17)15-11(2)14(12-5-4-10-19-12)16-6-8-18-9-7-16/h4-5,10-11,14H,3,6-9H2,1-2H3,(H,15,17)
InChIKeyHFTBMMBIZQNMHV-UHFFFAOYSA-N
MW282.41 g/mol
LogP2.04
Rot. Bonds5

About N-(1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl)propanamide

N-(1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl)propanamide (PubChem CID 3245518) has the molecular formula C14H22N2O2S and a molecular weight of 282.41 g/mol. Its IUPAC name is N-(1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl)propanamide.

Molecular Properties

Compound NameN-(1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl)propanamide
PubChem CID3245518
Molecular FormulaC14H22N2O2S
Molecular Weight282.41 g/mol
Exact Mass282.14
IUPAC NameN-(1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl)propanamide
SMILESCCC(=O)NC(C)C(c1cccs1)N1CCOCC1
InChIInChI=1S/C14H22N2O2S/c1-3-13(17)15-11(2)14(12-5-4-10-19-12)16-6-8-18-9-7-16/h4-5,10-11,14H,3,6-9H2,1-2H3,(H,15,17)
InChIKeyHFTBMMBIZQNMHV-UHFFFAOYSA-N
XLogP2.04
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.41
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl)propanamide?
The IUPAC name of N-(1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl)propanamide (CID 3245518) is N-(1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl)propanamide.
What is the SMILES notation for N-(1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl)propanamide?
The canonical SMILES for N-(1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl)propanamide is CCC(=O)NC(C)C(c1cccs1)N1CCOCC1.
What is the InChIKey of N-(1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl)propanamide?
The InChIKey is HFTBMMBIZQNMHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O2S/c1-3-13(17)15-11(2)14(12-5-4-10-19-12)16-6-8-18-9-7-16/h4-5,10-11,14H,3,6-9H2,1-2H3,(H,15,17).
What are the key properties of N-(1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl)propanamide?
N-(1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl)propanamide has a molecular weight of 282.41 g/mol, XLogP of 2.04, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl)propanamide is sourced from PubChem (CID 3245518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).