methyl 2-[methyl(1-thiophen-2-ylethyl)amino]acetate

C10H15NO2S — CID 60699787

IUPACmethyl 2-[methyl(1-thiophen-2-ylethyl)amino]acetate
SMILESCOC(=O)CN(C)C(C)c1cccs1
InChIInChI=1S/C10H15NO2S/c1-8(9-5-4-6-14-9)11(2)7-10(12)13-3/h4-6,8H,7H2,1-3H3
InChIKeyDUALUIIPSZAFPY-UHFFFAOYSA-N
MW213.30 g/mol
LogP1.91
Rot. Bonds4

About methyl 2-[methyl(1-thiophen-2-ylethyl)amino]acetate

methyl 2-[methyl(1-thiophen-2-ylethyl)amino]acetate (PubChem CID 60699787) has the molecular formula C10H15NO2S and a molecular weight of 213.30 g/mol. Its IUPAC name is methyl 2-[methyl(1-thiophen-2-ylethyl)amino]acetate.

Molecular Properties

Compound Namemethyl 2-[methyl(1-thiophen-2-ylethyl)amino]acetate
PubChem CID60699787
Molecular FormulaC10H15NO2S
Molecular Weight213.30 g/mol
Exact Mass213.08
IUPAC Namemethyl 2-[methyl(1-thiophen-2-ylethyl)amino]acetate
SMILESCOC(=O)CN(C)C(C)c1cccs1
InChIInChI=1S/C10H15NO2S/c1-8(9-5-4-6-14-9)11(2)7-10(12)13-3/h4-6,8H,7H2,1-3H3
InChIKeyDUALUIIPSZAFPY-UHFFFAOYSA-N
XLogP1.91
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.30
LogP ≤ 51.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1-[methyl(1-thiophen-2-ylethyl)amino]butan-2-one
CID 62040161
methyl N-methyl-N-(1-thiophen-2-ylethyl)carbamate
CID 115575425
2-[methyl(1-thiophen-2-ylethyl)amino]-N-(thiophen-2-ylmethyl)acetamide
CID 51271574
1-[methyl(1-thiophen-2-ylethyl)amino]-3-phenylpropan-2-one
CID 62051873
N-(4-chlorophenyl)-2-[methyl(1-thiophen-2-ylethyl)amino]acetamide
CID 18124847
1-(4-ethylphenyl)-2-[methyl(1-thiophen-2-ylethyl)amino]ethanone
CID 62052839
2-[carboxymethyl(1-thiophen-2-ylethyl)amino]acetic acid
CID 65065392
methyl 2-[(3-acetamido-3-thiophen-2-ylpropanoyl)-methylamino]acetate
CID 43409775
N-(4-methylsulfonylphenyl)-2-[methyl(1-thiophen-2-ylethyl)amino]acetamide
CID 18127362
N-(2,4-dimethylphenyl)-2-[methyl-[(1R)-1-thiophen-2-ylethyl]amino]acetamide
CID 40809350
N-(2,6-dimethylphenyl)-2-[[2-[methyl(1-thiophen-2-ylethyl)amino]acetyl]amino]acetamide
CID 18124910
methyl 2-[methyl(thiophen-2-ylsulfonyl)amino]acetate
CID 3312195

Frequently Asked Questions

What is the IUPAC name of methyl 2-[methyl(1-thiophen-2-ylethyl)amino]acetate?
The IUPAC name of methyl 2-[methyl(1-thiophen-2-ylethyl)amino]acetate (CID 60699787) is methyl 2-[methyl(1-thiophen-2-ylethyl)amino]acetate.
What is the SMILES notation for methyl 2-[methyl(1-thiophen-2-ylethyl)amino]acetate?
The canonical SMILES for methyl 2-[methyl(1-thiophen-2-ylethyl)amino]acetate is COC(=O)CN(C)C(C)c1cccs1.
What is the InChIKey of methyl 2-[methyl(1-thiophen-2-ylethyl)amino]acetate?
The InChIKey is DUALUIIPSZAFPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO2S/c1-8(9-5-4-6-14-9)11(2)7-10(12)13-3/h4-6,8H,7H2,1-3H3.
What are the key properties of methyl 2-[methyl(1-thiophen-2-ylethyl)amino]acetate?
methyl 2-[methyl(1-thiophen-2-ylethyl)amino]acetate has a molecular weight of 213.30 g/mol, XLogP of 1.91, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-[methyl(1-thiophen-2-ylethyl)amino]acetate is sourced from PubChem (CID 60699787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).