2,4-dimethyl-N-(2-thiophen-2-ylethyl)morpholine-2-carboxamide

C13H20N2O2S — CID 73439515

IUPAC2,4-dimethyl-N-(2-thiophen-2-ylethyl)morpholine-2-carboxamide
SMILESCN1CCOC(C)(C(=O)NCCc2cccs2)C1
InChIInChI=1S/C13H20N2O2S/c1-13(10-15(2)7-8-17-13)12(16)14-6-5-11-4-3-9-18-11/h3-4,9H,5-8,10H2,1-2H3,(H,14,16)
InChIKeyYMPLNFBMWZTONT-UHFFFAOYSA-N
MW268.38 g/mol
LogP1.13
Rot. Bonds4

About 2,4-dimethyl-N-(2-thiophen-2-ylethyl)morpholine-2-carboxamide

2,4-dimethyl-N-(2-thiophen-2-ylethyl)morpholine-2-carboxamide (PubChem CID 73439515) has the molecular formula C13H20N2O2S and a molecular weight of 268.38 g/mol. Its IUPAC name is 2,4-dimethyl-N-(2-thiophen-2-ylethyl)morpholine-2-carboxamide.

Molecular Properties

Compound Name2,4-dimethyl-N-(2-thiophen-2-ylethyl)morpholine-2-carboxamide
PubChem CID73439515
Molecular FormulaC13H20N2O2S
Molecular Weight268.38 g/mol
Exact Mass268.12
IUPAC Name2,4-dimethyl-N-(2-thiophen-2-ylethyl)morpholine-2-carboxamide
SMILESCN1CCOC(C)(C(=O)NCCc2cccs2)C1
InChIInChI=1S/C13H20N2O2S/c1-13(10-15(2)7-8-17-13)12(16)14-6-5-11-4-3-9-18-11/h3-4,9H,5-8,10H2,1-2H3,(H,14,16)
InChIKeyYMPLNFBMWZTONT-UHFFFAOYSA-N
XLogP1.13
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 ≤ 51.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(4R)-4-hydroxy-3,3,4-trimethyl-N-(2-thiophen-2-ylethyl)piperidine-1-carboxamide
CID 133110763
2,2-dichloro-1-methyl-N-(2-thiophen-2-ylethyl)cyclopropane-1-carboxamide
CID 42910761
3-amino-N-(2-thiophen-2-ylethyl)oxolane-3-carboxamide
CID 64892897
1-methyl-1-(1-methylpiperidin-4-yl)-3-(2-thiophen-2-ylethyl)urea
CID 59684905
(4S)-3,3-dimethyl-N-(2-thiophen-2-ylethyl)-4-(trifluoromethyl)piperidine-1-carboxamide
CID 124855638
3-propyl-1-(2-thiophen-2-ylethylcarbamoyl)pyrrolidine-3-carboxylic acid
CID 63145705
2,3-dihydroxy-4-oxo-4-pyrrolidin-1-yl-N-(2-thiophen-2-ylethyl)butanamide
CID 143155083
15-methyl-N-(2-thiophen-2-ylethyl)tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaene-15-carboxamide
CID 23596257
4-methyl-N-(2-thiophen-2-ylethyl)piperazine-2-carboxamide
CID 115178054
2-[4-methyl-4-(methylamino)piperidin-1-yl]-N-(2-thiophen-2-ylethyl)acetamide
CID 115305099
2-(4-amino-3,3-dimethylpiperidin-1-yl)-N-(2-thiophen-2-ylethyl)propanamide;hydrochloride
CID 120774618
1-cyano-N-(2-thiophen-2-ylethyl)cyclobutane-1-carboxamide
CID 78994707

Frequently Asked Questions

What is the IUPAC name of 2,4-dimethyl-N-(2-thiophen-2-ylethyl)morpholine-2-carboxamide?
The IUPAC name of 2,4-dimethyl-N-(2-thiophen-2-ylethyl)morpholine-2-carboxamide (CID 73439515) is 2,4-dimethyl-N-(2-thiophen-2-ylethyl)morpholine-2-carboxamide.
What is the SMILES notation for 2,4-dimethyl-N-(2-thiophen-2-ylethyl)morpholine-2-carboxamide?
The canonical SMILES for 2,4-dimethyl-N-(2-thiophen-2-ylethyl)morpholine-2-carboxamide is CN1CCOC(C)(C(=O)NCCc2cccs2)C1.
What is the InChIKey of 2,4-dimethyl-N-(2-thiophen-2-ylethyl)morpholine-2-carboxamide?
The InChIKey is YMPLNFBMWZTONT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O2S/c1-13(10-15(2)7-8-17-13)12(16)14-6-5-11-4-3-9-18-11/h3-4,9H,5-8,10H2,1-2H3,(H,14,16).
What are the key properties of 2,4-dimethyl-N-(2-thiophen-2-ylethyl)morpholine-2-carboxamide?
2,4-dimethyl-N-(2-thiophen-2-ylethyl)morpholine-2-carboxamide has a molecular weight of 268.38 g/mol, XLogP of 1.13, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethyl-N-(2-thiophen-2-ylethyl)morpholine-2-carboxamide is sourced from PubChem (CID 73439515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).