N-(3-morpholin-4-ylpropyl)-2-thiophen-2-ylacetamide

C13H20N2O2S — CID 2582267

IUPACN-(3-morpholin-4-ylpropyl)-2-thiophen-2-ylacetamide
SMILESO=C(Cc1cccs1)NCCCN1CCOCC1
InChIInChI=1S/C13H20N2O2S/c16-13(11-12-3-1-10-18-12)14-4-2-5-15-6-8-17-9-7-15/h1,3,10H,2,4-9,11H2,(H,14,16)
InChIKeyDUBPUZHNSCQTDZ-UHFFFAOYSA-N
MW268.38 g/mol
LogP1.13
Rot. Bonds6

About N-(3-morpholin-4-ylpropyl)-2-thiophen-2-ylacetamide

N-(3-morpholin-4-ylpropyl)-2-thiophen-2-ylacetamide (PubChem CID 2582267) has the molecular formula C13H20N2O2S and a molecular weight of 268.38 g/mol. Its IUPAC name is N-(3-morpholin-4-ylpropyl)-2-thiophen-2-ylacetamide.

Molecular Properties

Compound NameN-(3-morpholin-4-ylpropyl)-2-thiophen-2-ylacetamide
PubChem CID2582267
Molecular FormulaC13H20N2O2S
Molecular Weight268.38 g/mol
Exact Mass268.12
IUPAC NameN-(3-morpholin-4-ylpropyl)-2-thiophen-2-ylacetamide
SMILESO=C(Cc1cccs1)NCCCN1CCOCC1
InChIInChI=1S/C13H20N2O2S/c16-13(11-12-3-1-10-18-12)14-4-2-5-15-6-8-17-9-7-15/h1,3,10H,2,4-9,11H2,(H,14,16)
InChIKeyDUBPUZHNSCQTDZ-UHFFFAOYSA-N
XLogP1.13
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.38
LogP ≤ 51.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

Acetamide, N-tetrahydrofurfuryl-2-(2-thienyl)-
CID 531782
3-methyl-N-(1-morpholino-1-(thiophen-2-yl)propan-2-yl)butanamide
CID 16194567
N-(1-morpholino-1-(thiophen-2-yl)propan-2-yl)cyclopropanecarboxamide
CID 16195026
N-(3-morpholin-4-ylpropyl)thiophene-2-carboxamide
CID 2292963
N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)propanamide;hydrochloride
CID 6603216
N-(2-methoxyethyl)-3-[1-(3-thienylacetyl)piperidin-4-yl]propanamide
CID 23723469
N-(3-methoxypropyl)-2-(5-morpholin-4-ylsulfonylthiophen-2-yl)acetamide
CID 25163284
2,2-dimethyl-N-(1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl)propanamide
CID 16194562
N-ethyl-2-(5-morpholin-4-ylsulfonylthiophen-2-yl)acetamide
CID 25161681
Morpholine, 4-(2-thienylacetyl)-
CID 531781
4-(2-Hydroxyethyl)-3-(thiophen-2-yl)-3,4,5,6-tetrahydropyrazin-2-ol
CID 3070021
2-methyl-N-(1-methyl-2-morpholin-4-yl-2-thien-2-ylethyl)propanamide
CID 3235708

Frequently Asked Questions

What is the IUPAC name of N-(3-morpholin-4-ylpropyl)-2-thiophen-2-ylacetamide?
The IUPAC name of N-(3-morpholin-4-ylpropyl)-2-thiophen-2-ylacetamide (CID 2582267) is N-(3-morpholin-4-ylpropyl)-2-thiophen-2-ylacetamide.
What is the SMILES notation for N-(3-morpholin-4-ylpropyl)-2-thiophen-2-ylacetamide?
The canonical SMILES for N-(3-morpholin-4-ylpropyl)-2-thiophen-2-ylacetamide is O=C(Cc1cccs1)NCCCN1CCOCC1.
What is the InChIKey of N-(3-morpholin-4-ylpropyl)-2-thiophen-2-ylacetamide?
The InChIKey is DUBPUZHNSCQTDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O2S/c16-13(11-12-3-1-10-18-12)14-4-2-5-15-6-8-17-9-7-15/h1,3,10H,2,4-9,11H2,(H,14,16).
What are the key properties of N-(3-morpholin-4-ylpropyl)-2-thiophen-2-ylacetamide?
N-(3-morpholin-4-ylpropyl)-2-thiophen-2-ylacetamide has a molecular weight of 268.38 g/mol, XLogP of 1.13, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-morpholin-4-ylpropyl)-2-thiophen-2-ylacetamide is sourced from PubChem (CID 2582267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).