N-methyl-2-[[2-oxo-2-(2-thiophen-2-ylethylamino)ethyl]amino]acetamide

C11H17N3O2S — CID 8772566

IUPACN-methyl-2-[[2-oxo-2-(2-thiophen-2-ylethylamino)ethyl]amino]acetamide
SMILESCNC(=O)CNCC(=O)NCCc1cccs1
InChIInChI=1S/C11H17N3O2S/c1-12-10(15)7-13-8-11(16)14-5-4-9-3-2-6-17-9/h2-3,6,13H,4-5,7-8H2,1H3,(H,12,15)(H,14,16)
InChIKeyGMKZOPJXYZFVKZ-UHFFFAOYSA-N
MW255.34 g/mol
LogP-0.26
Rot. Bonds7

About N-methyl-2-[[2-oxo-2-(2-thiophen-2-ylethylamino)ethyl]amino]acetamide

N-methyl-2-[[2-oxo-2-(2-thiophen-2-ylethylamino)ethyl]amino]acetamide (PubChem CID 8772566) has the molecular formula C11H17N3O2S and a molecular weight of 255.34 g/mol. Its IUPAC name is N-methyl-2-[[2-oxo-2-(2-thiophen-2-ylethylamino)ethyl]amino]acetamide.

Molecular Properties

Compound NameN-methyl-2-[[2-oxo-2-(2-thiophen-2-ylethylamino)ethyl]amino]acetamide
PubChem CID8772566
Molecular FormulaC11H17N3O2S
Molecular Weight255.34 g/mol
Exact Mass255.10
IUPAC NameN-methyl-2-[[2-oxo-2-(2-thiophen-2-ylethylamino)ethyl]amino]acetamide
SMILESCNC(=O)CNCC(=O)NCCc1cccs1
InChIInChI=1S/C11H17N3O2S/c1-12-10(15)7-13-8-11(16)14-5-4-9-3-2-6-17-9/h2-3,6,13H,4-5,7-8H2,1H3,(H,12,15)(H,14,16)
InChIKeyGMKZOPJXYZFVKZ-UHFFFAOYSA-N
XLogP-0.26
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.34
LogP ≤ 5-0.26
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-methoxyethylamino)-N-(2-thiophen-2-ylethyl)acetamide;hydrochloride
CID 119687947
2-(cyclopropylmethylamino)-N-(2-thiophen-2-ylethyl)acetamide;hydrochloride
CID 119687934
2-hydroxy-N-(2-thiophen-2-ylethyl)acetamide
CID 13454159
N-[2-oxo-2-(2-thiophen-2-ylethylamino)ethyl]benzamide
CID 27770371
2-(cyclopropylamino)-N-(2-thiophen-2-ylethyl)acetamide
CID 60671964
2-ethylsulfonyl-N-(2-thiophen-2-ylethyl)acetamide
CID 47207166
3-bromo-N-(2-thiophen-2-ylethyl)propanamide
CID 82109303
4-hydroxy-N-(2-thiophen-2-ylethyl)butanamide
CID 13185709
3,3-dimethyl-5-oxo-5-(2-thiophen-2-ylethylamino)pentanoic acid
CID 62934552
4-amino-3,3-dimethyl-N-(2-thiophen-2-ylethyl)butanamide
CID 115157405
2-(2-thiophen-2-ylethylamino)acetic acid
CID 28888414
2-(3-chloro-2-methylanilino)-N-(2-thiophen-2-ylethyl)acetamide
CID 31666457

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-[[2-oxo-2-(2-thiophen-2-ylethylamino)ethyl]amino]acetamide?
The IUPAC name of N-methyl-2-[[2-oxo-2-(2-thiophen-2-ylethylamino)ethyl]amino]acetamide (CID 8772566) is N-methyl-2-[[2-oxo-2-(2-thiophen-2-ylethylamino)ethyl]amino]acetamide.
What is the SMILES notation for N-methyl-2-[[2-oxo-2-(2-thiophen-2-ylethylamino)ethyl]amino]acetamide?
The canonical SMILES for N-methyl-2-[[2-oxo-2-(2-thiophen-2-ylethylamino)ethyl]amino]acetamide is CNC(=O)CNCC(=O)NCCc1cccs1.
What is the InChIKey of N-methyl-2-[[2-oxo-2-(2-thiophen-2-ylethylamino)ethyl]amino]acetamide?
The InChIKey is GMKZOPJXYZFVKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O2S/c1-12-10(15)7-13-8-11(16)14-5-4-9-3-2-6-17-9/h2-3,6,13H,4-5,7-8H2,1H3,(H,12,15)(H,14,16).
What are the key properties of N-methyl-2-[[2-oxo-2-(2-thiophen-2-ylethylamino)ethyl]amino]acetamide?
N-methyl-2-[[2-oxo-2-(2-thiophen-2-ylethylamino)ethyl]amino]acetamide has a molecular weight of 255.34 g/mol, XLogP of -0.26, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-[[2-oxo-2-(2-thiophen-2-ylethylamino)ethyl]amino]acetamide is sourced from PubChem (CID 8772566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).