2-[3-(thiophen-2-ylmethylamino)phenoxy]acetamide

C13H14N2O2S — CID 43720191

IUPAC2-[3-(thiophen-2-ylmethylamino)phenoxy]acetamide
SMILESNC(=O)COc1cccc(NCc2cccs2)c1
InChIInChI=1S/C13H14N2O2S/c14-13(16)9-17-11-4-1-3-10(7-11)15-8-12-5-2-6-18-12/h1-7,15H,8-9H2,(H2,14,16)
InChIKeyGTWCSKHINOVJIU-UHFFFAOYSA-N
MW262.33 g/mol
LogP2.22
Rot. Bonds6

About 2-[3-(thiophen-2-ylmethylamino)phenoxy]acetamide

2-[3-(thiophen-2-ylmethylamino)phenoxy]acetamide (PubChem CID 43720191) has the molecular formula C13H14N2O2S and a molecular weight of 262.33 g/mol. Its IUPAC name is 2-[3-(thiophen-2-ylmethylamino)phenoxy]acetamide.

Molecular Properties

Compound Name2-[3-(thiophen-2-ylmethylamino)phenoxy]acetamide
PubChem CID43720191
Molecular FormulaC13H14N2O2S
Molecular Weight262.33 g/mol
Exact Mass262.08
IUPAC Name2-[3-(thiophen-2-ylmethylamino)phenoxy]acetamide
SMILESNC(=O)COc1cccc(NCc2cccs2)c1
InChIInChI=1S/C13H14N2O2S/c14-13(16)9-17-11-4-1-3-10(7-11)15-8-12-5-2-6-18-12/h1-7,15H,8-9H2,(H2,14,16)
InChIKeyGTWCSKHINOVJIU-UHFFFAOYSA-N
XLogP2.22
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.33
LogP ≤ 52.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[4-(thiophen-2-ylmethylamino)phenoxy]acetamide
CID 43711048
2-[3-[(4-bromothiophen-2-yl)methylamino]phenoxy]acetamide
CID 43720284
2-[3-[(3-aminothiophen-2-yl)methylamino]phenoxy]acetamide
CID 66386950
2-[3-[(5-chlorothiophen-2-yl)methylamino]phenoxy]acetamide
CID 43720144
3-(2-methoxyethoxy)-N-(thiophen-2-ylmethyl)aniline
CID 54803133
2-[3-[(4-bromo-5-methylthiophen-2-yl)methylamino]phenoxy]acetamide
CID 102832988
2-[3-[[5-(hydroxymethyl)furan-2-yl]methylamino]phenoxy]acetamide
CID 64579004
N-[3-(2-amino-2-oxoethoxy)phenyl]thiophene-2-carboxamide
CID 46529043
2-[3-[(2-ethylphenyl)methylamino]phenoxy]acetamide
CID 62391235
2-[3-[(4-methoxyphenyl)methylamino]phenoxy]acetamide
CID 43720165
2-[3-[(2,3-dihydroxyphenyl)methylamino]phenoxy]acetamide
CID 61317866
5-(thiophen-2-ylmethylamino)benzene-1,3-dicarboxamide
CID 28711815

Frequently Asked Questions

What is the IUPAC name of 2-[3-(thiophen-2-ylmethylamino)phenoxy]acetamide?
The IUPAC name of 2-[3-(thiophen-2-ylmethylamino)phenoxy]acetamide (CID 43720191) is 2-[3-(thiophen-2-ylmethylamino)phenoxy]acetamide.
What is the SMILES notation for 2-[3-(thiophen-2-ylmethylamino)phenoxy]acetamide?
The canonical SMILES for 2-[3-(thiophen-2-ylmethylamino)phenoxy]acetamide is NC(=O)COc1cccc(NCc2cccs2)c1.
What is the InChIKey of 2-[3-(thiophen-2-ylmethylamino)phenoxy]acetamide?
The InChIKey is GTWCSKHINOVJIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O2S/c14-13(16)9-17-11-4-1-3-10(7-11)15-8-12-5-2-6-18-12/h1-7,15H,8-9H2,(H2,14,16).
What are the key properties of 2-[3-(thiophen-2-ylmethylamino)phenoxy]acetamide?
2-[3-(thiophen-2-ylmethylamino)phenoxy]acetamide has a molecular weight of 262.33 g/mol, XLogP of 2.22, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(thiophen-2-ylmethylamino)phenoxy]acetamide is sourced from PubChem (CID 43720191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).