2-methoxy-2-phenyl-N-(thiophen-2-ylmethyl)ethanamine

C14H17NOS — CID 55038163

IUPAC2-methoxy-2-phenyl-N-(thiophen-2-ylmethyl)ethanamine
SMILESCOC(CNCc1cccs1)c1ccccc1
InChIInChI=1S/C14H17NOS/c1-16-14(12-6-3-2-4-7-12)11-15-10-13-8-5-9-17-13/h2-9,14-15H,10-11H2,1H3
InChIKeyLGJXYLKBAYGELC-UHFFFAOYSA-N
MW247.36 g/mol
LogP3.23
Rot. Bonds6

About 2-methoxy-2-phenyl-N-(thiophen-2-ylmethyl)ethanamine

2-methoxy-2-phenyl-N-(thiophen-2-ylmethyl)ethanamine (PubChem CID 55038163) has the molecular formula C14H17NOS and a molecular weight of 247.36 g/mol. Its IUPAC name is 2-methoxy-2-phenyl-N-(thiophen-2-ylmethyl)ethanamine.

Molecular Properties

Compound Name2-methoxy-2-phenyl-N-(thiophen-2-ylmethyl)ethanamine
PubChem CID55038163
Molecular FormulaC14H17NOS
Molecular Weight247.36 g/mol
Exact Mass247.10
IUPAC Name2-methoxy-2-phenyl-N-(thiophen-2-ylmethyl)ethanamine
SMILESCOC(CNCc1cccs1)c1ccccc1
InChIInChI=1S/C14H17NOS/c1-16-14(12-6-3-2-4-7-12)11-15-10-13-8-5-9-17-13/h2-9,14-15H,10-11H2,1H3
InChIKeyLGJXYLKBAYGELC-UHFFFAOYSA-N
XLogP3.23
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.36
LogP ≤ 53.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-benzyl-2-methoxy-2-phenylethanamine
CID 55038164
N-iodo-2-methoxy-2-phenylethanamine
CID 175279844
1-N-(thiophen-2-ylmethyl)propane-1,2-diamine
CID 61150337
1-(2-methoxy-2-phenylethyl)-2-methyl-3-(2-methyl-3-thiophen-2-ylpropyl)guanidine;hydroiodide
CID 111673983
2-(3-phenylpropoxy)-N-(thiophen-2-ylmethyl)propan-1-amine
CID 62584061
2-[(2-methoxy-2-phenylethyl)amino]-1-phenylethanol
CID 110176855
3-methyl-1-N-(thiophen-2-ylmethyl)pentane-1,2-diamine
CID 61150339
2-(benzenesulfonyl)-N-(thiophen-2-ylmethyl)propan-1-amine
CID 106512291
2-(2-methylpropoxy)-N-(thiophen-2-ylmethyl)propan-1-amine
CID 62567464
2-N-methyl-2-N-propyl-1-N-(thiophen-2-ylmethyl)propane-1,2-diamine
CID 62568611
2-N-[3-(diethylamino)propyl]-2-N-ethyl-1-N-(thiophen-2-ylmethyl)propane-1,2-diamine
CID 102997888
2-butoxy-N-(thiophen-2-ylmethyl)propan-1-amine
CID 62585075

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-2-phenyl-N-(thiophen-2-ylmethyl)ethanamine?
The IUPAC name of 2-methoxy-2-phenyl-N-(thiophen-2-ylmethyl)ethanamine (CID 55038163) is 2-methoxy-2-phenyl-N-(thiophen-2-ylmethyl)ethanamine.
What is the SMILES notation for 2-methoxy-2-phenyl-N-(thiophen-2-ylmethyl)ethanamine?
The canonical SMILES for 2-methoxy-2-phenyl-N-(thiophen-2-ylmethyl)ethanamine is COC(CNCc1cccs1)c1ccccc1.
What is the InChIKey of 2-methoxy-2-phenyl-N-(thiophen-2-ylmethyl)ethanamine?
The InChIKey is LGJXYLKBAYGELC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17NOS/c1-16-14(12-6-3-2-4-7-12)11-15-10-13-8-5-9-17-13/h2-9,14-15H,10-11H2,1H3.
What are the key properties of 2-methoxy-2-phenyl-N-(thiophen-2-ylmethyl)ethanamine?
2-methoxy-2-phenyl-N-(thiophen-2-ylmethyl)ethanamine has a molecular weight of 247.36 g/mol, XLogP of 3.23, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-2-phenyl-N-(thiophen-2-ylmethyl)ethanamine is sourced from PubChem (CID 55038163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).